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15963-37-8 | Cyclohexanol, 2-methyl-, (1S,2S)-
CAS No: 15963-37-8 Catalog No: AG001R8S MDL No:
Product Description
Catalog Number:
AG001R8S
Chemical Name:
Cyclohexanol, 2-methyl-, (1S,2S)-
CAS Number:
15963-37-8
Molecular Formula:
C7H14O
Molecular Weight:
114.1855
IUPAC Name:
(1S,2S)-2-methylcyclohexan-1-ol
InChI:
InChI=1S/C7H14O/c1-6-4-2-3-5-7(6)8/h6-8H,2-5H2,1H3/t6-,7-/m0/s1
InChI Key:
NDVWOBYBJYUSMF-BQBZGAKWSA-N
SMILES:
C[C@H]1CCCC[C@@H]1O
Properties
Complexity:
70.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
114.104g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
114.188g/mol
Monoisotopic Mass:
114.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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