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160281-93-6 | Cyclopentanenonanoic acid, 2-hexyl-
CAS No: 160281-93-6 Catalog No: AG001RSY MDL No:
Product Description
Catalog Number:
AG001RSY
Chemical Name:
Cyclopentanenonanoic acid, 2-hexyl-
CAS Number:
160281-93-6
Molecular Formula:
C20H38O2
Molecular Weight:
310.5145
IUPAC Name:
9-(2-hexylcyclopentyl)nonanoic acid
InChI:
InChI=1S/C20H38O2/c1-2-3-4-9-13-18-15-12-16-19(18)14-10-7-5-6-8-11-17-20(21)22/h18-19H,2-17H2,1H3,(H,21,22)
InChI Key:
HBJIUOGOLAADFU-UHFFFAOYSA-N
SMILES:
CCCCCCC1CCCC1CCCCCCCCC(=O)O
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.287g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
310.522g/mol
Monoisotopic Mass:
310.287g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
8.5
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