Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride
Basic information
- CAS
37457-09-3- Standard SMILES
CN(C)CCCC1(O)CCCCC1Sc1ccccc1.Cl- InChIKey
SBZBFDTZJCTDQL-UHFFFAOYSA-N- Molecular formula
- C17H28ClNOS
- Average molar mass
- 329.9 g/mol
- Monoisotopic mass
- 329.1580134
Names & identifiers
- Preferred name
- Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride
- IUPAC
- 1-[3-(dimethylamino)propyl]-2-phenylsulfanylcyclohexan-1-ol;hydrochloride
Names & synonyms
37457-09-31-(3-Dimethylaminopropyl)-2-(phenylthio)cyclohexanol hydrochlorideCyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochlorideRefChem:335451DTXSID409585561-[3-(Dimethylamino)propyl]-2-(phenylsulfanyl)cyclohexan-1-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
37457-09-3- PubChem CID
- 216574
- DTXSID
DTXSID40958556
Properties
Computed structural properties
- Topological polar surface area
- 48.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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