Consensus flow list

Identity

Type
Neutral molecule
CAS
541-41-3
EC
208-778-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for Ethyl Chlorocarbonate

Alternative labels

12

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string RIFGWPKJUGCATF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C3H5ClO2/c1-2-6-3(4)5/h2H2,1H3
IUPAC name chemrof:IUPAC_name Ethyl Chlorocarbonate
Molecular formula chemrof:molecular_formula C3H5ClO2
Molecular mass chemrof:molecular_mass 108.524
Monoisotopic mass chemrof:monoisotopic_mass 107.997807
SMILES string chemrof:smiles_string CCOC(=O)Cl

Known URLs

12

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=541-41-3 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.007.981 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1025 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1027186 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3183406 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/09601EZP9R enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0252038 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J53.980E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/10928 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1182 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q288339 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Ethyl_chloroformate enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
d7b992a4-8beb-4715-8d29-7048a7435290 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
35f81f7d-02ea-4000-8ecf-00999c1364ad Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
a2c5ae5c-bf21-4e0c-a18c-3a9393564009 Environmental → Air → Indoor EF 3.1 kg 4
e1337202-9903-47c1-a6ba-d7664841d863 Environmental → Air → Long-term EF 3.1 kg 0
502d1d78-cf1f-4aa2-9fe2-eaff6aa4974e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
b1646f18-1f6d-4f81-a0c2-2f49769af8a9 Environmental → Air → Unknown EF 3.1 kg 4
f4ce2f05-3798-4fe0-aeae-509829058662 Environmental → Ground → Agricultural EF 3.1 kg 4
d75ef113-eaba-4e1b-9526-ef57336f3c3c Environmental → Ground → Non-agricultural EF 3.1 kg 4
2b29e49c-18cc-4df8-9605-b50777ac7b42 Environmental → Ground → Unknown EF 3.1 kg 4
8531bf4b-a1c6-4a45-b456-cb08028a0bd9 Environmental → Water → Long-term EF 3.1 kg 0
1d57a896-9e0a-40f1-9b31-231041ecc18d Environmental → Water → Ocean EF 3.1 kg 4
1258813c-5096-46d4-a5eb-f06ba1deda62 Environmental → Water → Surface water EF 3.1 kg 4
24b85eda-ba4a-4de5-a022-32026832aacb 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-b70cc9cd7ecb4311",
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      "@language": "en",
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  "altLabel": [
    {
      "@value": "Carbonochloridic acid, ethyl ester",
      "@language": "en",
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    },
    {
      "@value": "Cathyl chloride",
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      }
    },
    {
      "@value": "Chloro ethyl formate",
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      "@value": "Chlorocarbonic acid ethyl ester",
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    },
    {
      "@value": "Chloroformic acid ethyl ester",
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    },
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      "@value": "Ethoxycarbonyl chloride",
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    },
    {
      "@value": "Ethyl carbonochloridate",
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    },
    {
      "@value": "Ethyl chloridocarbonate",
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    },
    {
      "@value": "Ethyl chloroformat",
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    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "208-778-5"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=208-778-5"
      ],
      "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"
  ]
}

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