Home Carboxys methyl (1R,3S)-rel-3-hydroxycyclohexane-1-carboxylate

methyl (1R,3S)-rel-3-hydroxycyclohexane-1-carboxylate

CAS No.:
6183-54-6
Catalog Number:
AG00IL2O
Molecular Formula:
C8H14O3
Molecular Weight:
158.1950
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$105
- +
250mg
97%
1 week
United States
$173
- +
1g
97%
1 week
United States
$374
- +
Product Description
Catalog Number:
AG00IL2O
Chemical Name:
methyl (1R,3S)-rel-3-hydroxycyclohexane-1-carboxylate
CAS Number:
6183-54-6
Molecular Formula:
C8H14O3
Molecular Weight:
158.1950
MDL Number:
MFCD27926393
IUPAC Name:
methyl (1R,3S)-3-hydroxycyclohexane-1-carboxylate
InChI:
InChI=1S/C8H14O3/c1-11-8(10)6-3-2-4-7(9)5-6/h6-7,9H,2-5H2,1H3/t6-,7+/m1/s1
InChI Key:
OXQRLBFDJMSRMM-RQJHMYQMSA-N
SMILES:
COC(=O)[C@@H]1CCC[C@@H](C1)O
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
158.094g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
158.197g/mol
Monoisotopic Mass:
158.094g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties