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24796-87-0 | Cyclohexanol, 2-bromo-
CAS No: 24796-87-0 Catalog No: AG002PGQ MDL No:MFCD18431043
Product Description
Catalog Number:
AG002PGQ
Chemical Name:
Cyclohexanol, 2-bromo-
CAS Number:
24796-87-0
Molecular Formula:
C6H11BrO
Molecular Weight:
179.0549
MDL Number:
MFCD18431043
IUPAC Name:
2-bromocyclohexan-1-ol
InChI:
InChI=1S/C6H11BrO/c7-5-3-1-2-4-6(5)8/h5-6,8H,1-4H2
InChI Key:
AAMCLCZHZXKWRV-UHFFFAOYSA-N
SMILES:
OC1CCCCC1Br
NSC Number:
104121
Properties
Complexity:
74.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Conformational analysis of cis-2-halocyclohexanols; solvent effects by NMR and theoretical calculations. | The Journal of organic chemistry 20110107 |
| Enantioseparation of chiral alcohols by complex formation and subsequent supercritical fluid extraction. | Chirality 20031101 |
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