Consensus flow list

Identity

Type
Neutral molecule
CAS
593-57-7
EC
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for Dimethyl Arsine

Alternative labels

2

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string HBNBMOGARBJBHS-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C2H7As/c1-3-2/h3H,1-2H3
IUPAC name chemrof:IUPAC_name Dimethyl Arsine
Molecular formula chemrof:molecular_formula C2H7As
Molecular mass chemrof:molecular_mass 106.0
Monoisotopic mass chemrof:monoisotopic_mass 105.976372
SMILES string chemrof:smiles_string C[AsH]C

Known URLs

4

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=593-57-7 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID80870647 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/79055 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q83128734 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
2c6e58fe-f71e-46c3-b1f6-653a70f261ad Environmental → Air → Aircraft cruise height EF 3.1 kg 2
f09a3e56-e1d6-499e-bc52-fa99472babbe Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
7a437ee5-c6ea-48d6-a35c-4d9d40525255 Environmental → Air → Indoor EF 3.1 kg 2
9a83cb58-0dc5-4f87-88fc-34e8ec670d3d Environmental → Air → Long-term EF 3.1 kg 0
d2c9451d-dda0-47d9-88b5-e9d7526aff43 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
2274ad62-cb26-4bbe-bce0-9b56d8a88306 Environmental → Air → Unknown EF 3.1 kg 2
5aaf7789-5f43-46e2-bd5a-2d2d94aea727 Environmental → Ground → Agricultural EF 3.1 kg 2
76faae5d-cc59-48b3-9534-fe6f08f1e85f Environmental → Ground → Non-agricultural EF 3.1 kg 2
f199aec7-f053-47c3-b936-a60f001aee22 Environmental → Ground → Unknown EF 3.1 kg 2
c6824f7d-647f-4d12-bb5d-64b77fdf39ab Environmental → Water → Long-term EF 3.1 kg 0
f096e43e-d04c-4800-b8e7-88ec7f530a38 Environmental → Water → Ocean EF 3.1 kg 2
315a560f-1ccd-4616-9874-07ea82a11a5f Environmental → Water → Surface water EF 3.1 kg 2
77828ca0-9fa8-4532-bd71-e538ddfff640 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-0c42a55de3367492",
  "prefLabel": [
    {
      "@value": "Dimethyl Arsine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Arsine, dimethyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=593-57-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dimethylarsine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=593-57-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C2H7As"
      ],
      "attested_by": {
        "C2H7As": [
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
        {
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          "prov:hadPrimarySource": [
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          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
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      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
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      "@value": [
        "HBNBMOGARBJBHS-UHFFFAOYSA-N"
      ],
      "attested_by": {
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      },
      "rdfs:label": "InChIKey",
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    },
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      "provenance": [
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        },
        {
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      ],
      "attested_by": {
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      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
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      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C2H7As/c1-3-2/h3H,1-2H3"
      ],
      "provenance": [
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        },
        {
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      ],
      "attested_by": {
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          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
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      "rdfs:label": "IUPAC name",
      "@value": [
        "Dimethyl Arsine"
      ],
      "provenance": {
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        ]
      },
      "attested_by": {
        "Dimethyl Arsine": [
          "opsin_iupac"
        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
        106.0
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
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            "C[AsH]C"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[AsH]C"
          ]
        }
      ],
      "attested_by": {
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          "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": [
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      ],
      "provenance": [
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          "prov:hadPrimarySource": [
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          ]
        }
      ],
      "attested_by": {
        "105.976372": [
          "rdkit_post_consensus",
          "rdkit_pre_consensus"
        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "references": [
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      "provenance": {
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    },
    {
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    },
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        "prov:wasDerivedFrom": "pubchem.by_cas[593-57-7]"
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    },
    {
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  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "2274ad62-cb26-4bbe-bce0-9b56d8a88306",
    "seed_source": "EF 3.1",
    "semantic_typing": {
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      "reason": "",
      "types": [
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      ],
      "provenance": {
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        "prov:wasDerivedFrom": "semantic_typing.rule.neutral_molecule"
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  },
  "classifications": {
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        "593-57-7"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=593-57-7"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
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        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        "prov:wasDerivedFrom": "cas_numbers"
      }
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  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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