1-(3-Aminopropyl)-4-phenylpiperidine-4-carbaldehyde--hydrogen chloride (1/2)
Basic information
- CAS
13073-15-9- Standard SMILES
[Cl-].[Cl-].[NH3+]CCC[NH+]1CCC(C=O)(c2ccccc2)CC1- InChIKey
QDHUQMPIRLHXNS-UHFFFAOYSA-N- Molecular formula
- C15H24Cl2N2O
- Average molar mass
- 319.3 g/mol
- Monoisotopic mass
- 318.1265688
Names & identifiers
- Preferred name
- 1-(3-Aminopropyl)-4-phenylpiperidine-4-carbaldehyde--hydrogen chloride (1/2)
- IUPAC
- 3-(4-formyl-4-phenylpiperidin-1-ium-1-yl)propylazanium dichloride
Names & synonyms
13073-15-9DTXSID209268741-(3-Aminopropyl)-4-phenylpiperidine-4-carbaldehyde--hydrogen chloride (1/2)RefChem:1054131DTXCID0013556801-(3-Aminopropyl)-4-phenylisonipecotaldehyde dihydrochlorideI.S. 31221-(3-Aminopropyl)-4-phenyl-4-piperidinecarboxaldehyde dihydrochloride1-(gamma-Amminopropil)-4-fenil-4-formilpiperidina dicloridrato [Italian]ISONIPECOTALDEHYDE, 1-(3-AMINOPROPYL)-4-PHENYL-, DIHYDROCHLORIDE1-(gamma-Amminopropil)-4-fenil-4-formilpiperidina dicloridrato
Database identifiers
- CAS
13073-15-9- PubChem CID
- 25672
Properties
Computed structural properties
- Topological polar surface area
- 49.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 253
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Compound notes
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