Consensus flow list

Identity

Type
Neutral molecule
CAS
624-54-4
EC
210-852-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for Propanoic Acid, Pentyl Ester

Alternative labels

9

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string TWSRVQVEYJNFKQ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H16O2/c1-3-5-6-7-10-8(9)4-2/h3-7H2,1-2H3
IUPAC name chemrof:IUPAC_name Propanoic Acid, Pentyl Ester
Molecular formula chemrof:molecular_formula C8H16O2
Molecular mass chemrof:molecular_mass 144.214
Monoisotopic mass chemrof:monoisotopic_mass 144.11503
SMILES string chemrof:smiles_string CCCCCOC(=O)CC

Known URLs

15

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=624-54-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:87373 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.009.866 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4041606 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=7931 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/826P0596UJ enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0031638 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J95.711I enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=45008 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/12217 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#3272 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/15691743 enrich_references.chebi_xrefs
reaxys reaxys:1747102 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q3050158 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Pentyl_propanoate enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
0abca93e-b6a0-4183-b6a0-341b140e8d9b Environmental → Air → Aircraft cruise height EF 3.1 kg 4
df0f9b43-5932-4dfe-a73f-db89d1299e56 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
7e9657fa-b2f9-4969-922e-b004e21e918b Environmental → Air → Indoor EF 3.1 kg 4
5c702f66-a45c-49b4-a783-383090a68207 Environmental → Air → Long-term EF 3.1 kg 0
f8593da6-bbd7-4b85-9572-9d36a0cbad92 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
b551103e-033f-400f-a4ce-e2e8f02af874 Environmental → Air → Unknown EF 3.1 kg 4
2e618135-2ac4-4612-b04b-097c73d1f863 Environmental → Ground → Agricultural EF 3.1 kg 4
e7eb0a29-1076-4192-8b09-5f72b35b55f8 Environmental → Ground → Non-agricultural EF 3.1 kg 4
21fa321a-d840-445a-a63a-ed6b213ee7aa Environmental → Ground → Unknown EF 3.1 kg 4
9e2da765-41fb-4562-9ddc-32cfeb5ed6e4 Environmental → Water → Long-term EF 3.1 kg 0
fbd90cb1-9328-436f-9981-c4c3a5384ff5 Environmental → Water → Ocean EF 3.1 kg 4
256bdcb8-74ec-495b-9bbf-0db11a649008 Environmental → Water → Surface water EF 3.1 kg 4
f7b332f1-4121-45ea-ac18-8f32aa1fc272 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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  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "http://www.w3.org/2004/02/skos/core#definition": [
    {
      "@value": "A propanoate ester of pentan-1-ol.",
      "@language": "en",
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  ],
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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