Consensus flow list

Identity

Type
Neutral molecule
CAS
51000-52-3
EC
256-905-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Vinyl Neodecanoate

Alternative labels

7

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string TVFJAZCVMOXQRK-UHFFFAOYSA-N, ZHXNRJQVYHYIMK-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C12H22O2/c1-5-14-11(13)9-7-6-8-10-12(2,3)4/h5H,1,6-10H2,2-4H3
IUPAC name chemrof:IUPAC_name Vinyl Neodecanoate
Molecular formula chemrof:molecular_formula C12H22O2
SMILES string chemrof:smiles_string C=COC(=O)CCCCCC(C)(C)C

Known URLs

11

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=45115-34-2 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=51000-52-3 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.051.715 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.120.474 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID60196392 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/9NDY01YYPT enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J248.965A enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/65294 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#3082 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q27272777 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Vinyl_neodecanoate enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
efa5378b-6cc0-4f4c-9484-76e519327b85 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
a0dae8d0-e901-427b-bb63-f099d0789619 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
2c4eee55-df88-4fd1-8e44-5d28bdd47e93 Environmental → Air → Indoor EF 3.1 kg 4
066133a9-f403-4094-ab39-c0b1a7a31b4e Environmental → Air → Long-term EF 3.1 kg 0
044f31e8-3437-4c92-8238-83ca515236fb Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
2ecd0697-b549-4b9b-9954-fef2cab15236 Environmental → Air → Unknown EF 3.1 kg 4
5bab5d82-5485-4356-8991-57a5c3b6ae38 Environmental → Ground → Agricultural EF 3.1 kg 4
141a1b50-51e3-45de-a728-c0f10ed00ca7 Environmental → Ground → Non-agricultural EF 3.1 kg 4
51a8b3bf-3fa2-417e-ad4c-83395b692e1a Environmental → Ground → Unknown EF 3.1 kg 4
16a63b79-a489-4ee3-8efe-9cf5786dff6b Environmental → Water → Long-term EF 3.1 kg 0
8014f346-06b7-45e1-9e8b-e9368c31ba0f Environmental → Water → Ocean EF 3.1 kg 4
c783c6de-e9db-41e2-81af-e8f439e71cf5 Environmental → Water → Surface water EF 3.1 kg 4
2eebd171-cd65-4781-9b53-dba5607cda6c Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-538dde5b980b4a81",
  "prefLabel": [
    {
      "@value": "Vinyl Neodecanoate",
      "@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": "Exxar Neo 10",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=51000-52-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Neodecanoic acid, ethenyl ester",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Neodecanoic acid, vinyl ester",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "Shivena 10",
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    },
    {
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    },
    {
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      "@language": "en",
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}

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