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Basic information
- CAS
5489-13-4- Standard SMILES
Cl.OC1(c2ccccc2)CNC(C2CCCCC2)C1- InChIKey
HCJUIKLCTYZMKJ-UHFFFAOYSA-N- Molecular formula
- C16H24ClNO
- Average molar mass
- 281.82 g/mol
- Monoisotopic mass
- 281.1546421
Names & identifiers
- Preferred name
- 3-Pyrrolidinol, 5-cyclohexyl-3-phenyl-, hydrochloride
- IUPAC
- 5-cyclohexyl-3-phenylpyrrolidin-3-ol;hydrochloride
Names & synonyms
3-Pyrrolidinol, 5-cyclohexyl-3-phenyl-, hydrochloride5489-13-4RefChem:10687575-Cyclohexyl-3-phenyl-3-pyrrolidinol hydrochlorideDTXSID009702195-Cyclohexyl-3-phenylpyrrolidin-3-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
5489-13-4- PubChem CID
- 200010
- DTXSID
DTXSID00970219
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 268
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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