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88505-51-5 | 11-Octadecenoic acid, 17-methyl-, (11Z)-
CAS No: 88505-51-5 Catalog No: AG0048ND MDL No:
Product Description
Catalog Number:
AG0048ND
Chemical Name:
11-Octadecenoic acid, 17-methyl-, (11Z)-
CAS Number:
88505-51-5
Molecular Formula:
C19H36O2
Molecular Weight:
296.4879
IUPAC Name:
17-methyloctadec-11-enoic acid
InChI:
InChI=1S/C19H36O2/c1-18(2)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19(20)21/h6,8,18H,3-5,7,9-17H2,1-2H3,(H,20,21)
InChI Key:
ZEROZPLNQDMWPW-UHFFFAOYSA-N
SMILES:
CC(CCCC/C=C\CCCCCCCCCC(=O)O)C
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.272g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
296.495g/mol
Monoisotopic Mass:
296.272g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
7.5
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