1-Propanol, 1-p-tolyl-2-amino-, hydrochloride
Basic information
- CAS
35086-98-7- Standard SMILES
Cc1ccc(C(O)C(C)[NH3+])cc1.[Cl-]- InChIKey
BBAWQAHNHLAYFY-UHFFFAOYSA-N- Molecular formula
- C10H16ClNO
- Average molar mass
- 201.69 g/mol
- Monoisotopic mass
- 201.0920418
Overview
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Names & identifiers
- Preferred name
- 1-Propanol, 1-p-tolyl-2-amino-, hydrochloride
- IUPAC
- [1-hydroxy-1-(4-methylphenyl)propan-2-yl]azanium chloride
- English name
- [1-hydroxy-1-(4-methylphenyl)propan-2-yl]azanium,chloride
- Molecular formula
- C10H16ClNO
- Molecular weight
- 201.69
Names & synonyms
1-Propanol, 1-p-tolyl-2-amino-, hydrochloridep-Tolylpropanolamine hydrochlorideBenzyl alcohol, p-methyl-alpha-(1-aminoethyl)-, hydrochlorideBENZYL ALCOHOL, alpha-(1-AMINOETHYL)-p-METHYL-, HYDROCHLORIDE[1-hydroxy-1-(4-methylphenyl)propan-2-yl]azanium;chloride2-AMINO-1-P-TOLYL-PROPAN-1-OL2-amino-1-(4-methylphenyl)propan-1-ol hydrochloride[1-hydroxy-1-(4-methylphenyl)propan-2-yl]azanium,chloride
Database identifiers
- CAS
35086-98-7- PubChem CID
- 37043
Properties
Computed structural properties
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 130
Chemistry & industry
Applications
Uses4-Methylnorephedrine Hydrochloride is the salt of 4-Methylnorephedrine, a metabolite of the designer drug Mephedrone. 4-Methylnorephedrine is detected in rats and human urine by GC-MS, and it is formed during the metabolism of Mephedrone by the demethylation of the primary amine and the reduction of the keto moeity.
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