Catalog Number |
ACMA00022611 |
IUPAC Name |
(Z)-14-methylpentadec-2-enoic acid |
Synonyms |
(Z)-14-methylpentadec-2-enoic acid;CHEBI:87146;cis-14-methylpentadec-2-enoic acid;(2Z)-14-methylpentadec-2-enoic acid;Q27159403;C12 |
Molecular Weight |
254.41g/mol |
Molecular Formula |
C16H30O2 |
Canonical SMILES |
CC(C)CCCCCCCCCCC=CC(=O)O |
InChI |
InChI=1S/C16H30O2/c1-15(2)13-11-9-7-5-3-4-6-8-10-12-14-16(17)18/h12,14-15H,3-11,13H2,1-2H3,(H,17,18)/b14-12- |
InChI Key |
WTXXSZUATXIAJO-OWBHPGMISA-N |
Complexity |
219 |
Covalently-Bonded Unit Count |
1 |
Exact Mass |
254.224580195g/mol |
Heavy Atom Count |
18 |
Hydrogen Bond Acceptor Count |
2 |
Monoisotopic Mass |
254.224580195g/mol |
Rotatable Bond Count |
12 |
Topological Polar Surface Area |
37.3Ų |
X Log P3 |
6.7 |