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1502-24-5 | Cyclohexanol, 2,3-dimethyl-
CAS No: 1502-24-5 Catalog No: AG001MEW MDL No:MFCD00001444
Product Description
Catalog Number:
AG001MEW
Chemical Name:
Cyclohexanol, 2,3-dimethyl-
CAS Number:
1502-24-5
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
MDL Number:
MFCD00001444
IUPAC Name:
2,3-dimethylcyclohexan-1-ol
InChI:
InChI=1S/C8H16O/c1-6-4-3-5-8(9)7(6)2/h6-9H,3-5H2,1-2H3
InChI Key:
KMVFQKNNDPKWOX-UHFFFAOYSA-N
SMILES:
CC1C(C)CCCC1O
EC Number:
216-121-9
Properties
Complexity:
90.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.12g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
128.215g/mol
Monoisotopic Mass:
128.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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