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CHEBI:179475 - 2,2-dimethyl-4-pentenoic acid

ChEBI IDCHEBI:179475
ChEBI Name2,2-dimethyl-4-pentenoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H12O2
Net Charge0
Average Mass128.171
Monoisotopic Mass128.08373
SMILESC=CCC(C)(C)C(=O)O
InChIInChI=1S/C7H12O2/c1-4-5-7(2,3)6(8)9/h4H,1,5H2,2-3H3,(H,8,9)
InChIKeyBGUAPYRHJPWVEM-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)
2,2-dimethyl-4-pentenoic acid (CHEBI:179475) is a methyl-branched fatty acid (CHEBI:62499)
IUPAC Name 
2,2-dimethylpent-4-enoic acid
Manual XrefsDatabases
LMFA01020121LIPID MAPS
123520ChemSpider
Registry NumbersSources
CAS:16386-93-9ChemIDplus