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147068-28-8 | 2-Cyclohexen-1-ol, 2-methyl-3-phenyl-
CAS No: 147068-28-8 Catalog No: AG001EKS MDL No:
Product Description
Catalog Number:
AG001EKS
Chemical Name:
2-Cyclohexen-1-ol, 2-methyl-3-phenyl-
CAS Number:
147068-28-8
Molecular Formula:
C13H16O
Molecular Weight:
188.2655
IUPAC Name:
2-methyl-3-phenylcyclohex-2-en-1-ol
InChI:
InChI=1S/C13H16O/c1-10-12(8-5-9-13(10)14)11-6-3-2-4-7-11/h2-4,6-7,13-14H,5,8-9H2,1H3
InChI Key:
CIUNPABFDMONSF-UHFFFAOYSA-N
SMILES:
OC1CCCC(=C1C)c1ccccc1
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.12g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.27g/mol
Monoisotopic Mass:
188.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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