Nickel(2+) Oxalate

[Ethanedioato(2-)-κO1,κO2]nickel
Ethanedioic acid, nickel(2+) salt (1:1)
Nickel oxalate
Nickel oxalate (1:1)
Nickel oxalate (NiC2O4)
Nickel(II) oxalate
Nickel, [ethanedioato(2-)-κO1,κO2]-
Oxalic acid, nickel(2+) salt (1:1)

Property	Value
InChI2D key string chemrof:inchi2d_key_string	DOLZKNFSRCEOFV-UHFFFAOYSA-L
InChI2D string chemrof:inchi2d_string	InChI=1S/C2H2O4.Ni/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+2/p-2
IUPAC name chemrof:IUPAC_name	Nickel(2+) Oxalate
Molecular formula chemrof:molecular_formula	C2NiO4
Molecular mass chemrof:molecular_mass	146.711
Monoisotopic mass chemrof:monoisotopic_mass	145.915001
SMILES string chemrof:smiles_string	O=C([O-])C(=O)[O-].[Ni+2]

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=547-67-1	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.008.122	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.039.864	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID5060277	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/1OGH7H8HA9	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J6.439D	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/68354	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q18212003	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
4f979040-e391-4e7a-a93f-47dad9efbe07	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
5ba7bf9e-3768-4c09-aad3-d958a4c4c4c4	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
9f46d068-68ae-4de9-82b4-18b2a087788f	Environmental → Air → Indoor	EF 3.1	kg	2
08a98c0d-a696-4f18-8406-e52ed8cd19ab	Environmental → Air → Long-term	EF 3.1	kg	0
81ee2c49-d3e1-4672-a92d-05c95a2a0590	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
902074ee-72dd-4dfe-9a09-0fc053c6dd3a	Environmental → Air → Unknown	EF 3.1	kg	2
828a1ecd-9ab2-4a08-b26f-47954aa6dc12	Environmental → Ground → Agricultural	EF 3.1	kg	2
b38ec9f3-61f9-4bad-86c7-77e700117076	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
a9917847-f8e6-438b-ace5-32c3f8d8e681	Environmental → Ground → Unknown	EF 3.1	kg	2
f08f65e4-c5bb-4a78-8f3e-dc146bf6b053	Environmental → Water → Long-term	EF 3.1	kg	0
6c62a74b-1bfd-4dbe-8d2c-28e21f2f30cd	Environmental → Water → Ocean	EF 3.1	kg	2
13313473-38f8-4d01-abd8-a63e6d7156c6	Environmental → Water → Surface water	EF 3.1	kg	2
d246b0fb-9984-4fa4-b716-cda73f2fafdd	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (55 changes)

Open the changes page

Flow object JSON

{
  "flow_object_id": "fo-01712bc40647e90a",
  "prefLabel": [
    {
      "@value": "Nickel(2+) Oxalate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "[Ethanedioato(2-)-κO1,κO2]nickel",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:547-67-1",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=547-67-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ethanedioic acid, nickel(2+) salt (1:1)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:547-67-1",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=547-67-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Nickel oxalate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:547-67-1",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=547-67-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Nickel oxalate (1:1)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:547-67-1",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=547-67-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Nickel oxalate (NiC2O4)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:547-67-1",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=547-67-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Nickel(II) oxalate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:547-67-1",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=547-67-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Nickel, [ethanedioato(2-)-κO1,κO2]-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:547-67-1",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=547-67-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Oxalic acid, nickel(2+) salt (1:1)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:547-67-1",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=547-67-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C2NiO4"
      ],
      "attested_by": {
        "C2NiO4": [
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:68354"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "O=C([O-])C(=O)[O-].[Ni+2]"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "DOLZKNFSRCEOFV-UHFFFAOYSA-L"
      ],
      "attested_by": {
        "DOLZKNFSRCEOFV-UHFFFAOYSA-L": [
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "InChIKey",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:68354"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "O=C([O-])C(=O)[O-].[Ni+2]"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "O=C([O-])C(=O)[O-].[Ni+2]"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Nickel(2+) Oxalate"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "O=C([O-])C(=O)[O-].[Ni+2]"
          ]
        }
      ],
      "attested_by": {
        "O=C([O-])C(=O)[O-].[Ni+2]": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C2H2O4.Ni/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+2/p-2"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Nickel(2+) Oxalate"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "O=C([O-])C(=O)[O-].[Ni+2]"
          ]
        }
      ],
      "attested_by": {
        "InChI=1S/C2H2O4.Ni/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+2/p-2": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "Nickel(2+) Oxalate"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "Nickel(2+) Oxalate"
        ]
      },
      "attested_by": {
        "Nickel(2+) Oxalate": [
          "opsin_iupac"
        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
        146.711
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C(=O)(C(=O)[O-])[O-].[Ni+2]"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "O=C([O-])C(=O)[O-].[Ni+2]"
          ]
        }
      ],
      "attested_by": {
        "146.711": [
          "rdkit_post_consensus",
          "rdkit_pre_consensus"
        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
      "@id": "https://w3id.org/chemrof/monoisotopic_mass",
      "rdfs:label": "Monoisotopic mass",
      "@value": [
        145.915001
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C(=O)(C(=O)[O-])[O-].[Ni+2]"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "O=C([O-])C(=O)[O-].[Ni+2]"
          ]
        }
      ],
      "attested_by": {
        "145.915001": [
          "rdkit_post_consensus",
          "rdkit_pre_consensus"
        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J6.439D",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:68354;CAS:547-67-1"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[547-67-1]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.008.122",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:68354;CAS:547-67-1"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[547-67-1]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.039.864",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:68354;CAS:547-67-1"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[547-67-1]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=547-67-1",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:68354;CAS:547-67-1"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[547-67-1]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID5060277",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:68354;CAS:547-67-1"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[547-67-1]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/1OGH7H8HA9",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:68354;CAS:547-67-1"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[547-67-1]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/68354",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:68354;CAS:547-67-1"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[547-67-1]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q18212003",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:68354;CAS:547-67-1"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[547-67-1]"
      }
    }
  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "08a98c0d-a696-4f18-8406-e52ed8cd19ab",
    "seed_source": "EF 3.1",
    "semantic_typing": {
      "rule": "multi_component_ionic",
      "reason": "",
      "types": [
        "https://w3id.org/chemrof/ChemicalSalt"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "semantic_typing.classify",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:wasDerivedFrom": "semantic_typing.rule.multi_component_ionic"
      }
    }
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "547-67-1"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=547-67-1"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=547-67-1"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "208-933-7"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=208-933-7"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/ChemicalSalt"
  ]
}

Nickel(2+) Oxalate

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

Keyboard