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871482-72-3 | 2-Cyclopenten-1-one,2-cyclohexyl-3-hydroxy-
CAS No: 871482-72-3 Catalog No: AG004KIY MDL No:
Product Description
Catalog Number:
AG004KIY
Chemical Name:
2-Cyclopenten-1-one,2-cyclohexyl-3-hydroxy-
CAS Number:
871482-72-3
Molecular Formula:
C11H16O2
Molecular Weight:
180.2435
IUPAC Name:
2-cyclohexyl-3-hydroxycyclopent-2-en-1-one
InChI:
InChI=1S/C11H16O2/c12-9-6-7-10(13)11(9)8-4-2-1-3-5-8/h8,12H,1-7H2
InChI Key:
JBLWIYNUTXUXIZ-UHFFFAOYSA-N
SMILES:
OC1=C(C2CCCCC2)C(=O)CC1
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.115g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.247g/mol
Monoisotopic Mass:
180.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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