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165601-77-4 | 2-Pentadecenoic acid, ethyl ester, (2E)-
CAS No: 165601-77-4 Catalog No: AG001W8B MDL No:
Product Description
Catalog Number:
AG001W8B
Chemical Name:
2-Pentadecenoic acid, ethyl ester, (2E)-
CAS Number:
165601-77-4
Molecular Formula:
C17H32O2
Molecular Weight:
268.4348
IUPAC Name:
ethyl pentadec-2-enoate
InChI:
InChI=1S/C17H32O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-4-2/h15-16H,3-14H2,1-2H3
InChI Key:
MXMABNZXUFMCGS-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC/C=C/C(=O)OCC
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.24g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.441g/mol
Monoisotopic Mass:
268.24g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
7.2
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