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CHEBI:38368 - pent-3-enoic acid

ChEBI IDCHEBI:38368
ChEBI Namepent-3-enoic acid
Stars
DefinitionA pentenoic acid having the double bond at position 3.
Last Modified13 September 2024
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC5H8O2
Net Charge0
Average Mass100.117
Monoisotopic Mass100.05243
SMILES[H]C(=CC)CC(=O)O
InChIInChI=1S/C5H8O2/c1-2-3-4-5(6)7/h2-3H,4H2,1H3,(H,6,7)
InChIKeyUIUWNILCHFBLEQ-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
pent-3-enoic acid (CHEBI:38368) is a pentenoic acid (CHEBI:25897)
pent-3-enoic acid (CHEBI:38368) is conjugate acid of pent-3-enoate (CHEBI:231931)
Incoming Relation(s)
cis-pent-3-enoic acid (CHEBI:38369) is a pent-3-enoic acid (CHEBI:38368)
trans-pent-3-enoic acid (CHEBI:38370) is a pent-3-enoic acid (CHEBI:38368)
pent-3-enoate (CHEBI:231931) is conjugate base of pent-3-enoic acid (CHEBI:38368)
IUPAC Name 
pent-3-enoic acid
Synonyms  Source
3-pentenoic acidNIST Chemistry WebBook
β-penteic acidLIPID MAPS
β-Aethyliden-propionsäureChEBI
1-propenylacetateChEBI
β-Butylen-α-carbonsäureChEBI
Pent-3-ensäureChEBI
Manual XrefsDatabases
LMFA01030006LIPID MAPS
TW581757BPatent
Registry NumbersSources
Reaxys:1743187Reaxys
CAS:5204-64-8NIST Chemistry WebBook
CAS:5204-64-8ChemIDplus