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120194-91-4 | Decanoic acid, cyclopentylmethyl ester
CAS No: 120194-91-4 Catalog No: AG000QJV MDL No:
Product Description
Catalog Number:
AG000QJV
Chemical Name:
Decanoic acid, cyclopentylmethyl ester
CAS Number:
120194-91-4
Molecular Formula:
C16H30O2
Molecular Weight:
254.4082
IUPAC Name:
cyclopentylmethyl decanoate
InChI:
InChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-13-16(17)18-14-15-11-9-10-12-15/h15H,2-14H2,1H3
InChI Key:
ACRFCWGJALRWRL-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC(=O)OCC1CCCC1
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.225g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.414g/mol
Monoisotopic Mass:
254.225g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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