2-(Tert-butylamino)-1-(3-chlorophenyl)propan-1-ol

Base Information

• Chemical Name: 2-(Tert-butylamino)-1-(3-chlorophenyl)propan-1-ol
• CAS No.: 119802-68-5
• Molecular Formula: C₁₃H₂₀ClNO
• Molecular Weight: 241.761
• DSSTox Substance ID: DTXSID50923119
• Nikkaji Number: J522.922G
• Wikipedia: Erythrohydrobupropion,Threohydrobupropion
• Wikidata: Q72518682
• ChEMBL ID: CHEMBL1304
• Mol file: 119802-68-5.mol

Synonyms:erythrohydrobupropion;hydrobupropion;threohydrobupropion

Chemical Property of 2-(Tert-butylamino)-1-(3-chlorophenyl)propan-1-ol

Chemical Property:

• Vapor Pressure: 2.07E-05mmHg at 25°C
• Refractive Index: 1.526
• Boiling Point: 347.2 °C at 760 mmHg
• Flash Point: 163.8 °C
• PSA: 32.26000
• Density: 1.078 g/cm³
• LogP: 3.54090
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 241.1233420
• Heavy Atom Count: 16
• Complexity: 215

Purity/Quality:

98%min ^*data from raw suppliers

3-Chloro-alpha-[1-[(1,1-dimethylethyl)amino]ethyl]benzenemethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(C1=CC(=CC=C1)Cl)O)NC(C)(C)C