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155320-77-7 | Cyclohexanol, 2-methoxy-, (1R,2S)-
CAS No: 155320-77-7 Catalog No: AG001NTP MDL No:
Product Description
Catalog Number:
AG001NTP
Chemical Name:
Cyclohexanol, 2-methoxy-, (1R,2S)-
CAS Number:
155320-77-7
Molecular Formula:
C7H14O2
Molecular Weight:
130.1849
IUPAC Name:
(1R,2S)-2-methoxycyclohexan-1-ol
InChI:
InChI=1S/C7H14O2/c1-9-7-5-3-2-4-6(7)8/h6-8H,2-5H2,1H3/t6-,7+/m1/s1
InChI Key:
DCQQZLGQRIVCNH-RQJHMYQMSA-N
SMILES:
CO[C@H]1CCCC[C@H]1O
Properties
Complexity:
83
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
130.099g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
130.187g/mol
Monoisotopic Mass:
130.099g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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