EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:72820 - 2-bromodecanoic acid

ChEBI IDCHEBI:72820
ChEBI Name2-bromodecanoic acid
Stars
DefinitionA bromo fatty acid that is decanoic acid carrying a single bromo substituent at position 2.
Last Modified1 February 2017
SubmitterSBeisken
DownloadsMolfile
FormulaC10H19BrO2
Net Charge0
Average Mass251.164
Monoisotopic Mass250.05684
SMILESCCCCCCCCC(Br)C(=O)O
InChIInChI=1S/C10H19BrO2/c1-2-3-4-5-6-7-8-9(11)10(12)13/h9H,2-8H2,1H3,(H,12,13)
InChIKeyKNLOTZNPRIFUAR-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-bromodecanoic acid (CHEBI:72820) is a 2-bromocarboxylic acid (CHEBI:134367)
2-bromodecanoic acid (CHEBI:72820) is a bromo fatty acid (CHEBI:61709)
2-bromodecanoic acid (CHEBI:72820) is a medium-chain fatty acid (CHEBI:59554)
2-bromodecanoic acid (CHEBI:72820) is a straight-chain fatty acid (CHEBI:59202)
IUPAC Name 
2-bromodecanoic acid
Synonyms  Source
2-bromocapric acidChEBI
α-bromodecanoic acidChEBI
α-bromocapric acidChEBI
Manual XrefsDatabases
LMFA01090003LIPID MAPS
Registry NumbersSources
Reaxys:1767667Reaxys
CAS:2623-95-2ChemIDplus