Consensus flow list

Identity

Type
Neutral molecule
CAS
111-55-7
EC
203-881-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Ethylene Di(acetate)

Alternative labels

18

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string JTXMVXSTHSMVQF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H10O4/c1-5(7)9-3-4-10-6(2)8/h3-4H2,1-2H3
IUPAC name chemrof:IUPAC_name Ethylene Di(acetate)
Molecular formula chemrof:molecular_formula C6H10O4
Molecular mass chemrof:molecular_mass 146.142
Monoisotopic mass chemrof:monoisotopic_mass 146.057909
SMILES string chemrof:smiles_string CC(=O)OCCOC(C)=O

Known URLs

13

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=111-55-7 enrich_references.consensus_cas_link
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=27252-83-1 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.529 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.158.686 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.223.220 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0026880 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=8853 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3186227 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/9E5JC3Q7WJ enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J10.596A enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/8121 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1993 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q27272433 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
aea36a61-5cc5-4ce6-b2ae-8a9c6c30c8cc Environmental → Air → Aircraft cruise height EF 3.1 kg 2
3a032147-ffc8-4d43-bf95-5206203231c6 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
8ddd43be-9942-4206-9b8a-d6222964b096 Environmental → Air → Indoor EF 3.1 kg 2
5ec54b4e-9669-4511-8420-92b1ba81c2cc Environmental → Air → Long-term EF 3.1 kg 0
9584344a-61d3-41a4-9751-7b6ea11ca131 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
cbd42943-4905-4d34-8ac1-68dd017bf047 Environmental → Air → Unknown EF 3.1 kg 2
41abb6f9-7de5-4734-9f28-000d8f28493a Environmental → Ground → Agricultural EF 3.1 kg 2
10a71f6f-62a9-4a7c-805b-ce4d6a851e41 Environmental → Ground → Non-agricultural EF 3.1 kg 2
144bc224-9864-4e85-a5a3-8d0e5b299071 Environmental → Ground → Unknown EF 3.1 kg 2
75206249-7dd2-4c86-ba7b-5528324e45b7 Environmental → Water → Long-term EF 3.1 kg 0
a49662a4-4285-4058-b51a-b386035b4074 Environmental → Water → Ocean EF 3.1 kg 2
513d36fa-3acd-4b82-a176-a8b0f9919d9b Environmental → Water → Surface water EF 3.1 kg 2
b93053c2-7b0c-4f1a-b212-101941b7c538 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-af3e5ea61ceb5c41",
  "prefLabel": [
    {
      "@value": "Ethylene Di(acetate)",
      "@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": "1,2-Diacetoxyethane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:111-55-7",
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          "https://commonchemistry.cas.org/detail?cas_rn=111-55-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,2-Ethanediol, 1,2-diacetate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,2-Ethanediol, diacetate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,2-Ethanediyl diacetate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-(Acetyloxy)ethyl acetate",
      "@language": "en",
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      "provenance": {
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Acetyloxyethyl acetate",
      "@language": "en",
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    },
    {
      "@value": "Aptex Donor H-plus",
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    },
    {
      "@value": "EGDA",
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    },
    {
      "@value": "Ethanediol diacetate",
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      "@value": "Ethylene acetate",
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    },
    {
      "@value": "Ethylene diacetate",
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    },
    {
      "@value": "Ethylene diethanoate",
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    },
    {
      "@value": "Ethylene glycol diacetate",
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    },
    {
      "@value": "Ethylene glycol, diacetate",
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    },
    {
      "@value": "Flodur 3",
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    },
    {
      "@value": "Glycol diacetate",
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    },
    {
      "@value": "Novaset NH",
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      }
    },
    {
      "@value": "Novaset NH Medium Hardener",
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