Consensus flow list

Identity

Type
NeutralMolecule
CAS
112-15-2
EC
203-940-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 2-(2-ethoxyethoxy)ethyl Acetate

Alternative labels

14

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string FPZWZCWUIYYYBU-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H16O4/c1-3-10-4-5-11-6-7-12-8(2)9/h3-7H2,1-2H3
IUPAC name chemrof:IUPAC_name 2-(2-ethoxyethoxy)ethyl Acetate
Molecular formula chemrof:molecular_formula C8H16O4
Molecular mass chemrof:molecular_mass 176.212
Monoisotopic mass chemrof:monoisotopic_mass 176.104859
SMILES string chemrof:smiles_string CCOCCOCCOC(C)=O

Known URLs

10

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=112-15-2 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.582 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6026905 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=8702 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3185106 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/W5EIM81UBX enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J22.125B enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/8165 enrich_references.pubchem_compound
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/1737113 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q27292336 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
f1415e81-d28a-432b-880f-873db5fb4dd6 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
3e8de501-1ecc-4a49-af3c-fcda9bc6e32c Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
d7bbf76e-a342-460f-9e86-5bcb04c8c191 Environmental → Air → Indoor EF 3.1 kg 4
37876f57-7527-48b3-b82d-8e78cd029fd9 Environmental → Air → Long-term EF 3.1 kg 0
728b8bee-86e1-4495-a7e3-bac6828ba391 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
0f7a98f1-a8a2-4bab-8f9c-81d8e996e89d Environmental → Air → Unknown EF 3.1 kg 4
843cc1b0-a6fc-4df2-81fb-544ec5a0f2dd Environmental → Ground → Agricultural EF 3.1 kg 4
ca8c0a3b-5a71-4d18-80ae-f4bb48ab32b8 Environmental → Ground → Non-agricultural EF 3.1 kg 4
6efd3ebe-6a6b-40d0-b566-c890901d369c Environmental → Ground → Unknown EF 3.1 kg 4
00856c68-27c0-4806-a226-c8280f02cd5f Environmental → Water → Long-term EF 3.1 kg 0
3a340772-d2da-4778-b6a2-5f91297c7168 Environmental → Water → Ocean EF 3.1 kg 4
c628c209-a2cd-43e0-9f2f-a633686c7e44 Environmental → Water → Surface water EF 3.1 kg 4
1fe2e7d5-a10c-466c-b729-d1794a079b28 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
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "203-940-1"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=203-940-1"
      ],
      "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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