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10152-62-2 | Cyclopropaneoctanoic acid, 2-octyl-, methyl ester
CAS No: 10152-62-2 Catalog No: AG0004PW MDL No:
Product Description
Catalog Number:
AG0004PW
Chemical Name:
Cyclopropaneoctanoic acid, 2-octyl-, methyl ester
CAS Number:
10152-62-2
Molecular Formula:
C20H38O2
Molecular Weight:
310.5145
IUPAC Name:
methyl 8-(2-octylcyclopropyl)octanoate
InChI:
InChI=1S/C20H38O2/c1-3-4-5-6-8-11-14-18-17-19(18)15-12-9-7-10-13-16-20(21)22-2/h18-19H,3-17H2,1-2H3
InChI Key:
WKDUVICSOMXTKJ-UHFFFAOYSA-N
SMILES:
CCCCCCCCC1CC1CCCCCCCC(=O)OC
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:
0
Isotope Atom Count:
0
Molecular Weight:
310.522g/mol
Monoisotopic Mass:
310.287g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
8.3
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