Consensus flow list

4-oxo-4-[2-(prop-2-enoyloxy)ethoxy]butanoic Acid

fo-50ecf5156c75c69b

Identity

Type
Neutral molecule
CAS
50940-49-3
EC
478-130-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 4-oxo-4-[2-(prop-2-enoyloxy)ethoxy]butanoic Acid

Alternative labels

17

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string UZDMJPAQQFSMMV-UHFFFAOYSA-M, UZDMJPAQQFSMMV-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C9H12O6/c1-2-8(12)14-5-6-15-9(13)4-3-7(10)11/h2H,1,3-6H2,(H,10,11)/p-1
IUPAC name chemrof:IUPAC_name Acryloyloxyethyl succinate
Molecular formula chemrof:molecular_formula C9H11O6-, C9H12O6
Molecular mass chemrof:molecular_mass 215.181, 216.189
Monoisotopic mass chemrof:monoisotopic_mass 215.056112, 216.063388
SMILES string chemrof:smiles_string C=CC(=O)OCCOC(=O)CCC(=O)[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=50940-49-3 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=84579-32-8 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.105.171 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.133.861 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4044820 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3189015 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/Q9AZV5U0FH enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J38.877G enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/175956 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27287148 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
198ffbd1-1061-4fb9-a0bb-c48da99be422 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
e49d0507-b84f-4e29-9d59-5f99eae41e8b Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
335af0c7-ca95-4c4c-9f5c-90fd2a561ae0 Environmental → Air → Indoor EF 3.1 kg 4
7e6d0644-8106-4fcf-9299-ceda07f41bdb Environmental → Air → Long-term EF 3.1 kg 0
7c7f0d8b-a814-4d5e-9379-42c1fd5d7c08 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
32b8129a-fac6-454e-aff6-327059b284cf Environmental → Air → Unknown EF 3.1 kg 4
c4dea023-cc18-4c94-944d-725c0178676d Environmental → Ground → Agricultural EF 3.1 kg 4
dfa9ba53-0989-4b17-8794-2acde3030afe Environmental → Ground → Non-agricultural EF 3.1 kg 4
347a9456-ef44-4cb3-9e05-7ddc60fbe168 Environmental → Ground → Unknown EF 3.1 kg 4
09fd9361-44c3-490b-891d-2fefcf7ebcc6 Environmental → Water → Long-term EF 3.1 kg 0
ab1d4ffa-642c-442e-8782-9360317f2b53 Environmental → Water → Ocean EF 3.1 kg 4
ab3e8dbd-242a-4a5d-9029-1100bd7d2a4a Environmental → Water → Surface water EF 3.1 kg 4
39999883-936e-4e5b-b524-34ca14472c4b Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON 
{
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