2-(Butylamino)-1-phenylpropan-1-ol--hydrogen chloride (1/1)
Basic information
- CAS
63991-36-6- Standard SMILES
CCCC[NH2+]C(C)C(O)c1ccccc1.[Cl-]- InChIKey
OOKUCEPETMEKJK-UHFFFAOYSA-N- Molecular formula
- C13H22ClNO
- Average molar mass
- 243.77 g/mol
- Monoisotopic mass
- 243.138992
Names & identifiers
- Preferred name
- 2-(Butylamino)-1-phenylpropan-1-ol--hydrogen chloride (1/1)
- IUPAC
- butyl-(1-hydroxy-1-phenylpropan-2-yl)azanium chloride
Names & synonyms
63991-36-6DTXSID909818192-(Butylamino)-1-phenylpropan-1-ol--hydrogen chloride (1/1)RefChem:1061502DTXCID901409088(+-)-alpha-(1-(n-Butylamino)ethyl)benzyl alcohol hydrochlorideBENZYL ALCOHOL, alpha-(1-(n-BUTYLAMINO)ETHYL)-, HYDROCHLORIDE, (+-)-
Database identifiers
- CAS
63991-36-6- PubChem CID
- 46270
Properties
Computed structural properties
- Topological polar surface area
- 36.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 155
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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