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1596-16-3 | Phenol, 4-cyclohexyl-3-methyl-
CAS No: 1596-16-3 Catalog No: AG001R7J MDL No:
Product Description
Catalog Number:
AG001R7J
Chemical Name:
Phenol, 4-cyclohexyl-3-methyl-
CAS Number:
1596-16-3
Molecular Formula:
C13H18O
Molecular Weight:
190.2814
IUPAC Name:
4-cyclohexyl-3-methylphenol
InChI:
InChI=1S/C13H18O/c1-10-9-12(14)7-8-13(10)11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3
InChI Key:
XQZZRMOYMBRVNA-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1)C)C1CCCCC1
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.136g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.286g/mol
Monoisotopic Mass:
190.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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