Consensus flow list

Identity

Type
NeutralMolecule
CAS
6166-86-5
EC
228-204-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 2,4,6,8,10-pentamethyl-1,3,5,7,9,2,4,6,8,10-pentoxapentasilecane

Alternative labels

5

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string HGPDWMTUQRNTQT-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C5H20O5Si5/c1-11-6-12(2)8-14(4)10-15(5)9-13(3)7-11/h11-15H,1-5H3
IUPAC name chemrof:IUPAC_name 2,4,6,8,10-pentamethyl-1,3,5,7,9,2,4,6,8,10-pentoxapentasilecane
Molecular formula chemrof:molecular_formula C5H20O5Si5
Molecular mass chemrof:molecular_mass 300.64
Monoisotopic mass chemrof:monoisotopic_mass 300.015706
SMILES string chemrof:smiles_string C[SiH]1O[SiH](C)O[SiH](C)O[SiH](C)O[SiH](C)O1

Known URLs

3

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=6166-86-5 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/80304 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q72499929 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
434e3943-5a0a-4b85-882c-9946371f96e1 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
6ca4e026-d053-42a6-b4f8-0b10482fb02d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
1d5343aa-770c-4f1b-99ef-36bb7cdd4bcb Environmental → Air → Indoor EF 3.1 kg 4
e81b424f-521c-428e-ba38-fc680c74512a Environmental → Air → Long-term EF 3.1 kg 0
c6de1696-231b-4d73-8f84-96f18fd5fb99 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
09ce9a2b-b995-4e2c-8a1c-910b205b6073 Environmental → Air → Unknown EF 3.1 kg 4
b3d771ce-7fa2-4da1-89ab-5ad47b1fadd4 Environmental → Ground → Agricultural EF 3.1 kg 4
b5fb2f32-f9fe-4dfc-a3d4-ff799a47fb47 Environmental → Ground → Non-agricultural EF 3.1 kg 4
010e1d59-945b-4c67-b6c3-5804179523bf Environmental → Ground → Unknown EF 3.1 kg 4
5eed9cbb-b00c-4e8b-a6fd-35bfe0220adc Environmental → Water → Long-term EF 3.1 kg 0
57e8e08f-a9e1-4051-9e3f-17b4618ddee5 Environmental → Water → Ocean EF 3.1 kg 4
f5aa7e5d-cd43-40b5-aff9-a06b137394a4 Environmental → Water → Surface water EF 3.1 kg 4
30d5ba27-4a27-4319-ab46-077eb2962f11 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-4102cf87dd85d4cf",
  "prefLabel": [
    {
      "@value": "2,4,6,8,10-pentamethyl-1,3,5,7,9,2,4,6,8,10-pentoxapentasilecane",
      "@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": "1,3,5,7,9-Pentamethylcyclopentasiloxane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:6166-86-5",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=6166-86-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,4,6,8,10-Pentamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:6166-86-5",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=6166-86-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,4,6,8,10-Pentamethylcyclopentasiloxane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:6166-86-5",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=6166-86-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Cyclopentasiloxane, 2,4,6,8,10-pentamethyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:6166-86-5",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=6166-86-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Pentamethylcyclopentasiloxane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:6166-86-5",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=6166-86-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C5H20O5Si5"
      ],
      "attested_by": {
        "C5H20O5Si5": [
          "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:80304"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[SiH]1O[SiH](C)O[SiH](C)O[SiH](C)O[SiH](C)O1"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "HGPDWMTUQRNTQT-UHFFFAOYSA-N"
      ],
      "attested_by": {
        "HGPDWMTUQRNTQT-UHFFFAOYSA-N": [
          "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:80304"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[SiH]1O[SiH](C)O[SiH](C)O[SiH](C)O[SiH](C)O1"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "C[SiH]1O[SiH](C)O[SiH](C)O[SiH](C)O[SiH](C)O1"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "2,4,6,8,10-pentamethyl-1,3,5,7,9,2,4,6,8,10-pentoxapentasilecane"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[SiH]1O[SiH](C)O[SiH](C)O[SiH](C)O[SiH](C)O1"
          ]
        }
      ],
      "attested_by": {
        "C[SiH]1O[SiH](C)O[SiH](C)O[SiH](C)O[SiH](C)O1": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C5H20O5Si5/c1-11-6-12(2)8-14(4)10-15(5)9-13(3)7-11/h11-15H,1-5H3"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "2,4,6,8,10-pentamethyl-1,3,5,7,9,2,4,6,8,10-pentoxapentasilecane"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[SiH]1O[SiH](C)O[SiH](C)O[SiH](C)O[SiH](C)O1"
          ]
        }
      ],
      "attested_by": {
        "InChI=1S/C5H20O5Si5/c1-11-6-12(2)8-14(4)10-15(5)9-13(3)7-11/h11-15H,1-5H3": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "2,4,6,8,10-pentamethyl-1,3,5,7,9,2,4,6,8,10-pentoxapentasilecane"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "2,4,6,8,10-pentamethyl-1,3,5,7,9,2,4,6,8,10-pentoxapentasilecane"
        ]
      },
      "attested_by": {
        "2,4,6,8,10-pentamethyl-1,3,5,7,9,2,4,6,8,10-pentoxapentasilecane": [
          "opsin_iupac"
        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
        300.64
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[SiH]1O[SiH](O[SiH](O[SiH](O[SiH](O1)C)C)C)C"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[SiH]1O[SiH](C)O[SiH](C)O[SiH](C)O[SiH](C)O1"
          ]
        }
      ],
      "attested_by": {
        "300.64": [
          "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": [
        300.015706
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[SiH]1O[SiH](O[SiH](O[SiH](O[SiH](O1)C)C)C)C"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[SiH]1O[SiH](C)O[SiH](C)O[SiH](C)O[SiH](C)O1"
          ]
        }
      ],
      "attested_by": {
        "300.015706": [
          "rdkit_post_consensus",
          "rdkit_pre_consensus"
        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "references": [
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=6166-86-5",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:80304;CAS:6166-86-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[6166-86-5]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/80304",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:80304;CAS:6166-86-5"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[6166-86-5]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q72499929",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:80304;CAS:6166-86-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[6166-86-5]"
      }
    }
  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "010e1d59-945b-4c67-b6c3-5804179523bf",
    "seed_source": "EF 3.1",
    "semantic_typing": {
      "rule": "neutral_molecule",
      "reason": "",
      "types": [
        "https://w3id.org/chemrof/NeutralMolecule"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "semantic_typing.classify",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:wasDerivedFrom": "semantic_typing.rule.neutral_molecule"
      }
    }
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "6166-86-5"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=6166-86-5"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=6166-86-5"
        }
      ],
      "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": [
        "228-204-7"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=228-204-7"
      ],
      "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/NeutralMolecule"
  ]
}

Keyboard

?
Show or hide this map
Esc
Close

More as the sections are built.