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6957-08-0 | Cyclohexanol,1-(3-methylphenyl)-
CAS No: 6957-08-0 Catalog No: AG005KS6 MDL No:MFCD00021395
Product Description
Catalog Number:
AG005KS6
Chemical Name:
Cyclohexanol,1-(3-methylphenyl)-
CAS Number:
6957-08-0
Molecular Formula:
C13H18O
Molecular Weight:
190.2814
MDL Number:
MFCD00021395
IUPAC Name:
1-(3-methylphenyl)cyclohexan-1-ol
InChI:
InChI=1S/C13H18O/c1-11-6-5-7-12(10-11)13(14)8-3-2-4-9-13/h5-7,10,14H,2-4,8-9H2,1H3
InChI Key:
BUMLNDUUDOQELU-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)C1(O)CCCCC1
NSC Number:
66197
Properties
Complexity:
182
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:
3
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