Basic information
- CAS
2845-32-1- Standard SMILES
CCC(O)(C[NH3+])c1ccccc1.[Cl-]- InChIKey
CSFWNXJWAZDYSB-UHFFFAOYSA-N- Molecular formula
- C10H16ClNO
- Average molar mass
- 201.69 g/mol
- Monoisotopic mass
- 201.0920418
Names & identifiers
- Preferred name
- 1-Amino-2-phenylbutan-2-olato--hydrogen chlorido (1/1)
- IUPAC
- (2-hydroxy-2-phenylbutyl)azanium chloride
Names & synonyms
2845-32-1DTXSID309510961-Amino-2-phenylbutan-2-olato--hydrogen chlorido (1/1)RefChem:1054836DTXCID901379229alpha-(Aminomethyl)-alpha-ethylbenzyl alcohol hydrochlorideBENZYL ALCOHOL, alpha-(AMINOMETHYL)-alpha-ETHYL-, HYDROCHLORIDE
Database identifiers
- CAS
2845-32-1- PubChem CID
- 17830
Properties
Computed structural properties
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 132
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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