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88505-45-7 | 7-Tetradecenoic acid, 12-methyl-, (Z)-
CAS No: 88505-45-7 Catalog No: AG00489V MDL No:
Product Description
Catalog Number:
AG00489V
Chemical Name:
7-Tetradecenoic acid, 12-methyl-, (Z)-
CAS Number:
88505-45-7
Molecular Formula:
C15H28O2
Molecular Weight:
240.3816
IUPAC Name:
12-methyltetradec-7-enoic acid
InChI:
InChI=1S/C15H28O2/c1-3-14(2)12-10-8-6-4-5-7-9-11-13-15(16)17/h4,6,14H,3,5,7-13H2,1-2H3,(H,16,17)
InChI Key:
XVHJIIMFAZYVRO-UHFFFAOYSA-N
SMILES:
CCC(CCC/C=C\CCCCCC(=O)O)C
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.209g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.387g/mol
Monoisotopic Mass:
240.209g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
5.4
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