Consensus flow list

Identity

Type
Neutral molecule
CAS
82428-30-6
EC
688-147-2
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 7-oxabicyclo[4.1.0]hept-3-ylmethyl 2-methylprop-2-enoate

Alternative labels

13

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string FYYIUODUDSPAJQ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C11H16O3/c1-7(2)11(12)13-6-8-3-4-9-10(5-8)14-9/h8-10H,1,3-6H2,2H3
IUPAC name chemrof:IUPAC_name 7-oxabicyclo[4.1.0]hept-3-ylmethyl 2-methylprop-2-enoate
Molecular formula chemrof:molecular_formula C11H16O3
Molecular mass chemrof:molecular_mass 196.246
Monoisotopic mass chemrof:monoisotopic_mass 196.109944
SMILES string chemrof:smiles_string C=C(C)C(=O)OCC1CCC2OC2C1

Known URLs

7

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=128703-08-2 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=82428-30-6 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID701002678 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0247495 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J154.038F enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/14645478 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q126611718 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
2828704c-8508-4bb2-9733-e9a5a9881b04 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
a185ca11-20d3-4ade-8fb2-180eb42a4d4d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
3ba50cef-2dfa-4b13-8a21-81627c54c557 Environmental → Air → Indoor EF 3.1 kg 2
1447dfc0-f878-43c3-80e9-d24f615e3f64 Environmental → Air → Long-term EF 3.1 kg 0
88270ecd-579d-44de-b61d-79ce2316724b Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
ff4ad168-8969-4ebc-b41c-f705a734392f Environmental → Air → Unknown EF 3.1 kg 2
ff21cd18-4c50-4979-8b25-ac9b95693dfc Environmental → Ground → Agricultural EF 3.1 kg 2
e38d9507-f47c-434b-9f7e-91b3f2d60edc Environmental → Ground → Non-agricultural EF 3.1 kg 2
b8c81ec2-6847-45e8-9556-68a88a984e69 Environmental → Ground → Unknown EF 3.1 kg 2
b3041807-fda7-44c1-973c-602ea37c39aa Environmental → Water → Long-term EF 3.1 kg 0
e70a8350-c4f4-4e44-a84b-4b566f6bd9b1 Environmental → Water → Ocean EF 3.1 kg 2
71e7f42f-f103-4f7b-bcda-92c38f3fb728 Environmental → Water → Surface water EF 3.1 kg 2
091bdb11-56e2-4436-9d3a-d995720456ac Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-446153a5cd4918c0",
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      "@value": "7-oxabicyclo[4.1.0]hept-3-ylmethyl 2-methylprop-2-enoate",
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  "altLabel": [
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    },
    {
      "@value": "2-Propenoic acid, 2-methyl-, 7-oxabicyclo[4.1.0]hept-3-ylmethyl ester",
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  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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