Basic information
- CAS
31898-13-2- Standard SMILES
CNC(C)CC12CC3CC(CC(O)(C3)C1)C2.Cl- InChIKey
IABJZMVJXLVXPQ-UHFFFAOYSA-N- Molecular formula
- C14H26ClNO
- Average molar mass
- 259.81 g/mol
- Monoisotopic mass
- 259.1702921
Names & identifiers
- Preferred name
- 3-Adamantanol, 1-(2-methylaminopropyl)-, hydrochloride
- IUPAC
- 3-[2-(methylamino)propyl]adamantan-1-ol;hydrochloride
- English name
- 1-(2-Methylaminopropyl)-3-adamantanol hydrochloride
- Molecular formula
- C14H25NO.ClH
- Molecular weight
- 259.82
Names & synonyms
31898-13-23-ADAMANTANOL, 1-(2-METHYLAMINOPROPYL)-, HYDROCHLORIDEAdamantane, 3-hydroxy-1-(2-methylaminopropyl)-, hydrochlorideRefChem:2762611-(2-METHYLAMINOPROPYL)-3-ADAMANTANOL HYDROCHLORIDE3-[2-(methylamino)propyl]adamantan-1-ol;hydrochlorideDTXSID709538173-[2-(Methylamino)propyl]adamantan-1-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
31898-13-2- PubChem CID
- 36015
- DTXSID
DTXSID70953817
Properties
Computed structural properties
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 274
Chemistry & industry
Suppliers1 total
Capot Chemical Co., Ltd+86 (0) 571 85 58 67 18
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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