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115730-93-3 | Tetradecenoic acid, 13-methyl-, (Z)-
CAS No: 115730-93-3 Catalog No: AG000GS9 MDL No:
Product Description
Catalog Number:
AG000GS9
Chemical Name:
Tetradecenoic acid, 13-methyl-, (Z)-
CAS Number:
115730-93-3
Molecular Formula:
C15H28O2
Molecular Weight:
240.3816
IUPAC Name:
13-methyltetradec-2-enoic acid
InChI:
InChI=1S/C15H28O2/c1-14(2)12-10-8-6-4-3-5-7-9-11-13-15(16)17/h11,13-14H,3-10,12H2,1-2H3,(H,16,17)
InChI Key:
HNGBGNIRFVZXOQ-UHFFFAOYSA-N
SMILES:
CC(CCCCCCCCC/C=C\C(=O)O)C
Properties
Complexity:
207
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:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
6.2
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