(4R)-4-methyloctan-4-ol
Basic information
- CAS
627034-18-8- Standard SMILES
CCCC[C@](C)(O)CCC- InChIKey
RXSIKQJQLQRQQY-SECBINFHSA-N- Molecular formula
- C9H20O
- Average molar mass
- 144.25 g/mol
- Monoisotopic mass
- 144.15141526
Names & identifiers
- Preferred name
- (4R)-4-methyloctan-4-ol
- IUPAC
- (4R)-4-methyloctan-4-ol
Names & synonyms
(4R)-4-methyloctan-4-ol4-Methyl-4-octanol, (4R)-A96R224L2B4-Octanol, 4-methyl-, (4R)-(4R)-4-METHYL-4-OCTANOL627034-18-8
Database identifiers
- CAS
627034-18-8- PubChem CID
- 6994074
- UNII
- A96R224L2B
- Nikkaji
- J1.945.099F
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 80.8
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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