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141779-19-3 | Cyclohexanol, 5-methyl-2-(1-methylethyl)-1-(phenylmethyl)-
CAS No: 141779-19-3 Catalog No: AG001H2T MDL No:
Product Description
Catalog Number:
AG001H2T
Chemical Name:
Cyclohexanol, 5-methyl-2-(1-methylethyl)-1-(phenylmethyl)-
CAS Number:
141779-19-3
Molecular Formula:
C17H26O
Molecular Weight:
246.3877
IUPAC Name:
1-benzyl-5-methyl-2-propan-2-ylcyclohexan-1-ol
InChI:
InChI=1S/C17H26O/c1-13(2)16-10-9-14(3)11-17(16,18)12-15-7-5-4-6-8-15/h4-8,13-14,16,18H,9-12H2,1-3H3
InChI Key:
FQOHSFIFSFJRHU-UHFFFAOYSA-N
SMILES:
CC1CCC(C(C1)(O)Cc1ccccc1)C(C)C
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.198g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.394g/mol
Monoisotopic Mass:
246.198g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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