Basic information
- CAS
63990-91-0- Standard SMILES
Cl.OC(c1ccccc1)(c1cccnc1)C1CCCCC1- InChIKey
RLADIDBSFKIKLB-UHFFFAOYSA-N- Molecular formula
- C18H22ClNO
- Average molar mass
- 303.8 g/mol
- Monoisotopic mass
- 303.138992
Overview
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Names & identifiers
- Preferred name
- alpha-Cyclohexyl-alpha-(3-pyridyl)benzyl alcohol hydrochloride
- IUPAC
- cyclohexyl-phenyl-pyridin-3-ylmethanol;hydrochloride
Names & synonyms
alpha-Cyclohexyl-alpha-(3-pyridyl)benzyl alcohol hydrochlorideDB-307594
Database identifiers
- CAS
63990-91-0- PubChem CID
- 57352000
- DTXSID
DTXSID90981793
Properties
Computed structural properties
- Topological polar surface area
- 33.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 294
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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