(S)-3-Amino-4-(2-chlorophenyl)butanoic acid hydrochloride

Base Information

• Chemical Name: (S)-3-Amino-4-(2-chlorophenyl)butanoic acid hydrochloride
• CAS No.: 270596-36-6
• Molecular Formula: C10H12ClNO2
• Molecular Weight: 250.12200
• Hs Code.: 2922499990
• DSSTox Substance ID: DTXSID50375831
• Mol file: 270596-36-6.mol

Synonyms:270596-36-6;(S)-3-AMINO-4-(2-CHLOROPHENYL)BUTANOIC ACID HYDROCHLORIDE;331763-52-1;(3S)-3-amino-4-(2-chlorophenyl)butanoic Acid Hydrochloride;(3S)-3-amino-4-(2-chlorophenyl)butanoic acid;hydrochloride;2-Chloro-L-beta-homophenylalanine hydrochloride;(S)-3-Amino-4-(2-chlorophenyl)butyric acid hydrochloride;(S)-3-amino-4-(2-chloro-phenyl)-butyric acid-HCl;(S)-3-AMINO-4-(2-CHLOROPHENYL)-BUTYRIC ACID-HCL;H-beta-HoPhe(2-Cl)-OH*HCl;DTXSID50375831;H-Phe(2-Cl)-(C#CH2)OH.HCl;MFCD01860996;AKOS016843764;FD10305;AC-22150;PS-12085;(s)-3-amino-4-(2-chlorophenyl)butyric acid hcl;(S)-3-Amino-4-(2-chloro-phenyl)-butyric acid HCl;(3S)-3-Amino-4-(2-chlorophenyl)butanoic acid--hydrogen chloride (1/1)

Chemical Property of (S)-3-Amino-4-(2-chlorophenyl)butanoic acid hydrochloride

Chemical Property:

• Vapor Pressure: 8.13E-06mmHg at 25°C
• Boiling Point: 360.2oC at 760mmHg
• PKA: 3.74±0.10(Predicted)
• Flash Point: 171.6oC
• PSA: 63.32000
• Density: 1.287±0.06 g/cm3(Predicted)
• LogP: 3.18680
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 249.0323340
• Heavy Atom Count: 15
• Complexity: 199

Purity/Quality:

98%min ^*data from raw suppliers

(S)-3-Amino-4-(2-chlorophenyl)butanoicacidhydrochloride 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)CC(CC(=O)O)N)Cl.Cl
• Isomeric SMILES: C1=CC=C(C(=C1)C[C@@H](CC(=O)O)N)Cl.Cl