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16536-57-5 | Cyclohexanol, 2-bromo-, (1R,2S)-rel-
CAS No: 16536-57-5 Catalog No: AG001W3K MDL No:
Product Description
Catalog Number:
AG001W3K
Chemical Name:
Cyclohexanol, 2-bromo-, (1R,2S)-rel-
CAS Number:
16536-57-5
Molecular Formula:
C6H11BrO
Molecular Weight:
179.0549
IUPAC Name:
(1S,2R)-2-bromocyclohexan-1-ol
InChI:
InChI=1S/C6H11BrO/c7-5-3-1-2-4-6(5)8/h5-6,8H,1-4H2/t5-,6+/m1/s1
InChI Key:
AAMCLCZHZXKWRV-RITPCOANSA-N
SMILES:
O[C@@H]1CCCC[C@@H]1Br
Properties
Complexity:
74.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
177.999g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.057g/mol
Monoisotopic Mass:
177.999g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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