Consensus flow list

Identity

Type
Neutral molecule
CAS
18868-43-4
EC
242-637-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for Molybdenum Dioxide

Alternative labels

1

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string QXYJCZRRLLQGCR-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/Mo.2O
IUPAC name chemrof:IUPAC_name Molybdenum Dioxide
Molecular formula chemrof:molecular_formula MoO2
Molecular mass chemrof:molecular_mass 127.938
Monoisotopic mass chemrof:monoisotopic_mass 129.895237
SMILES string chemrof:smiles_string [O]=[Mo]=[O]

Known URLs

9

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=18868-43-4 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.038.746 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID10879986 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.270.094F enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J96.263E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/29320 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q415673 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Molybdenum(IV)_oxide enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Molybdenum_dioxide enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
07edba2c-89fb-4a6e-ae61-2f390ba0ea49 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
c8fc9b01-9049-48f6-9296-59818a86af55 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
653873f0-1fb9-432e-866f-322ee931ad18 Environmental → Air → Indoor EF 3.1 kg 4
f9286048-94e6-497c-8321-b08943882d36 Environmental → Air → Long-term EF 3.1 kg 0
087a924a-bcb9-4efc-a5dd-6138605c61ee Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
53b48e6c-97e2-4c80-ba4a-ff349db5f363 Environmental → Air → Unknown EF 3.1 kg 4
ee4f3a43-f1a8-4266-9d7e-5e12cc08eca1 Environmental → Ground → Agricultural EF 3.1 kg 4
263bffcf-9b37-46d3-a941-7de0703cd70e Environmental → Ground → Non-agricultural EF 3.1 kg 4
bc18e061-fb1d-40b1-92ba-9b4909ba3159 Environmental → Ground → Unknown EF 3.1 kg 4
6675e079-87d8-46d4-a9f9-8cf171f0fb95 Environmental → Water → Long-term EF 3.1 kg 0
bbeda693-ea3a-43a5-b5f3-a7ce9bac0f27 Environmental → Water → Ocean EF 3.1 kg 4
b4bf474a-b58d-4cb3-a212-1826e6f887f2 Environmental → Water → Surface water EF 3.1 kg 4
773918fc-852d-41ee-9784-d1e2acf432b9 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-af155dd1cbeeb6a7",
  "prefLabel": [
    {
      "@value": "Molybdenum Dioxide",
      "@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": "Molybdenum oxide (MoO2)",
      "@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=18868-43-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "MoO2"
      ],
      "attested_by": {
        "MoO2": [
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
        {
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          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[O]=[Mo]=[O]"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
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      "@value": [
        "QXYJCZRRLLQGCR-UHFFFAOYSA-N"
      ],
      "attested_by": {
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      },
      "rdfs:label": "InChIKey",
      "provenance": [
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          ]
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      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
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      "rdfs:label": "SMILES",
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      "provenance": [
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          ]
        },
        {
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          "prov:hadPrimarySource": [
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          ]
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      ],
      "attested_by": {
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        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
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      ],
      "provenance": [
        {
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          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[O]=[Mo]=[O]"
          ]
        }
      ],
      "attested_by": {
        "InChI=1S/Mo.2O": [
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        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
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      ],
      "provenance": {
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        ]
      },
      "attested_by": {
        "Molybdenum Dioxide": [
          "opsin_iupac"
        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
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      "rdfs:label": "Molecular mass",
      "@value": [
        127.938
      ],
      "provenance": [
        {
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          ]
        },
        {
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          "prov:hadPrimarySource": [
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          ]
        }
      ],
      "attested_by": {
        "127.938": [
          "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": [
        129.895237
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "O=[Mo]=O"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[O]=[Mo]=[O]"
          ]
        }
      ],
      "attested_by": {
        "129.895237": [
          "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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  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "07edba2c-89fb-4a6e-ae61-2f390ba0ea49",
    "seed_source": "EF 3.1",
    "semantic_typing": {
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      "rdfs:seeAlso": [
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      "http://www.w3.org/2004/02/skos/core#exactMatch": [
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  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
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}

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