1-Methyl-1,2-cyclohexanediol, trans-
Basic information
- CAS
105929-88-2- Standard SMILES
C[C@@]1(O)CCCC[C@H]1O- InChIKey
IOZFUGDROBQPNP-RNFRBKRXSA-N- Molecular formula
- C7H14O2
- Average molar mass
- 130.18 g/mol
- Monoisotopic mass
- 130.09937969
Names & identifiers
- Preferred name
- 1-Methyl-1,2-cyclohexanediol, trans-
- IUPAC
- cis-(1R,2R)-1-methylcyclohexane-1,2-diol
Names & synonyms
19534-08-8NSC-88867NZ2CGQ257K1-Methyl-1,2-cyclohexanediol, trans-1,2-Cyclohexanediol, 1-methyl-, trans-RefChem:1055718trans-1-Methyl-1,2-cyclohexanedioltrans-1,2-Dihydroxy-1-methyl-cyclohexane(1r,2r)-1-methylcyclohexane-1,2-diol(1r,2r)-1-methyl-1,2-cyclohexanediolrel-(1R,2R)-1-Methyl-1,2-cyclohexanediol7FR27G2VRQ
Show more names
SCHEMBL6543457NSC888671-Methyl-trans-1,2-dihydroxycyclohexane1-Methyl-1,2-cyclohexanediol, (1R,2R)-1,2-Cyclohexanediol, 1-methyl-, (1R,2R)-1,2-Cyclohexanediol, 1-methyl-, (1R-trans)-1,2-Cyclohexanediol, 1-methyl-, (1R,2R)-rel-105929-88-2
Database identifiers
- CAS
105929-88-2、19534-08-8- PubChem CID
- 259186
- UNII
- 7FR27G2VRQ、NZ2CGQ257K
- EC Number
- 105-342-5
- Nikkaji
- J411.531G
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 103
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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