Consensus flow list

Identity

Type
NeutralMolecule
CAS
26272-90-2
EC
247-578-2
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for Hexadecyl Chlorocarbonate

Alternative labels

8

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string HOQUWXSARQBQCW-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C17H33ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-17(18)19/h2-16H2,1H3
IUPAC name chemrof:IUPAC_name Hexadecyl Chlorocarbonate
Molecular formula chemrof:molecular_formula C17H33ClO2
Molecular mass chemrof:molecular_mass 304.902
Monoisotopic mass chemrof:monoisotopic_mass 304.216908
SMILES string chemrof:smiles_string CCCCCCCCCCCCCCCCOC(=O)Cl

Known URLs

8

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=26272-90-2 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.043.238 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID9067194 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=137911 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/WRC65MY1ID enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J208.249G enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/97633 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27292789 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
637cf1c4-51dc-432c-9a34-e7af13fcd919 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
5016c040-8e14-4a09-b095-7b465326d423 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
67f0b8e6-491c-4cf4-8ef0-10548b8a464e Environmental → Air → Indoor EF 3.1 kg 2
61b19c5d-5f02-4068-a1a0-953dd19ad086 Environmental → Air → Long-term EF 3.1 kg 0
7196518f-a99b-48ed-8cf7-30ebf209a5c5 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
01c074de-0aa0-4d32-be99-729a8790ff9d Environmental → Air → Unknown EF 3.1 kg 2
5710e005-8888-4443-a208-e7fb77e7d0dd Environmental → Ground → Agricultural EF 3.1 kg 2
ce4cfbbe-fda7-49d1-b7ce-ddc9228c9af6 Environmental → Ground → Non-agricultural EF 3.1 kg 2
aec5a97b-315f-4a9d-b832-d9dddfa75d3a Environmental → Ground → Unknown EF 3.1 kg 2
ccc99f84-02ef-4866-a741-db4ae9991e61 Environmental → Water → Long-term EF 3.1 kg 0
4fd2a7e7-ef68-4c1d-937b-6675faeca800 Environmental → Water → Ocean EF 3.1 kg 2
96bd6cac-f3c6-4fe1-bc89-1deaeabdac87 Environmental → Water → Surface water EF 3.1 kg 2
e5b10b55-12c3-493a-bddb-c8677dea66fc Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-e7360c86328bcb0f",
  "prefLabel": [
    {
      "@value": "Hexadecyl Chlorocarbonate",
      "@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": "Carbonochloridic acid, hexadecyl ester",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:26272-90-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=26272-90-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Cetyl chloroformate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:26272-90-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=26272-90-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Chloroformic acid cetyl ester",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "CAS:26272-90-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=26272-90-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Formic acid, chloro-, hexadecyl ester",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:26272-90-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=26272-90-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Hexadecyl carbonochloridate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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          "https://commonchemistry.cas.org/detail?cas_rn=26272-90-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Hexadecyl chloroformate",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "n-Hexadecyl chloroformate",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Palmityloxycarbonyl chloride",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
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        "C17H33ClO2"
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        },
        {
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      "rdfs:label": "InChIKey",
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        }
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    },
    "https://w3id.org/chemrof/smiles_string": {
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      "provenance": [
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          "prov:hadPrimarySource": [
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      "attested_by": {
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
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      "rdfs:label": "InChI",
      "@value": [
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    },
    "https://w3id.org/chemrof/IUPAC_name": {
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      "rdfs:label": "IUPAC name",
      "@value": [
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      "provenance": {
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        "prov:hadPrimarySource": [
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        ]
      },
      "attested_by": {
        "Hexadecyl Chlorocarbonate": [
          "opsin_iupac"
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    },
    "https://w3id.org/chemrof/molecular_mass": {
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      "provenance": [
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        },
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      ],
      "attested_by": {
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      },
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    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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        },
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        }
      ],
      "attested_by": {
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        ]
      },
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    }
  },
  "references": [
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}

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