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20431-83-8 | Cyclohexanol, 2-(methylamino)-, (1R,2S)-rel-
CAS No: 20431-83-8 Catalog No: AG0029EK MDL No:MFCD08899333
Product Description
Catalog Number:
AG0029EK
Chemical Name:
Cyclohexanol, 2-(methylamino)-, (1R,2S)-rel-
CAS Number:
20431-83-8
Molecular Formula:
C7H15NO
Molecular Weight:
129.2001
MDL Number:
MFCD08899333
IUPAC Name:
(1R,2S)-2-(methylamino)cyclohexan-1-ol
InChI:
InChI=1S/C7H15NO/c1-8-6-4-2-3-5-7(6)9/h6-9H,2-5H2,1H3/t6-,7+/m0/s1
InChI Key:
HILGAVODIXBHHR-NKWVEPMBSA-N
SMILES:
CN[C@H]1CCCC[C@H]1O
Properties
Complexity:
85
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
129.115g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
129.203g/mol
Monoisotopic Mass:
129.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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