Basic information
- CAS
4913-06-8- Standard SMILES
CC1(c2ccccc2)OCC(C2CCCC[NH2+]2)O1.[Cl-]- InChIKey
PKRKZGJTFLIHIV-UHFFFAOYSA-N- Molecular formula
- C15H22ClNO2
- Average molar mass
- 283.79 g/mol
- Monoisotopic mass
- 283.1339066
Names & identifiers
- Preferred name
- 2-(2-Methyl-2-phenyl-1,3-dioxolan-4-yl)piperidine--hydrogen chloride (1/1)
- IUPAC
- 2-(2-methyl-2-phenyl-1,3-dioxolan-4-yl)piperidin-1-ium chloride
Names & synonyms
4913-06-8DTXSID709641652-(2-Methyl-2-phenyl-1,3-dioxolan-4-yl)piperidine--hydrogen chloride (1/1)RefChem:1060905DTXCID701391871beta-2-Methyl-2-phenyl-4-(2-piperidyl)-1,3-dioxolane hydrochloride1,3-DIOXOLANE, 2-METHYL-2-PHENYL-4-(2-PIPERIDYL)-, HYDROCHLORIDE, beta-
Database identifiers
- CAS
4913-06-8- PubChem CID
- 21020
Properties
Computed structural properties
- Topological polar surface area
- 35.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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