Vaccine Lab / Alfa Chemistry
Trans-10-octadecenoic acid

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Trans-10-octadecenoic acid

Catalog Number ACM67701115
CAS 67701-11-5
Synonyms Isooleic acid
IUPAC Name Octadec-10-enoic acid
Molecular Weight 282.5
Molecular Formula C18H34O2
Canonical SMILES CCCCCCCC=CCCCCCCCCC(=O)O
InChI InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h8-9H,2-7,10-17H2,1H3,(H,19,20)/b9-8+
InChI Key QXJSBBXBKPUZAA-CMDGGOBGSA-N
Complexity 234
Covalently-Bonded Unit Count 1
Defined Atom Stereocenter Count 0
Exact Mass 282.255880323
Heavy Atom Count 20
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
Isomeric SMILES CCCCCCC/C=C/CCCCCCCCC(=O)O
Monoisotopic Mass 282.255880323
Rotatable Bond Count 15
Topological Polar Surface Area 37.3 Ų
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