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

Base Information

• Chemical Name: (S)-3-Amino-4-(2-methylphenyl)butanoic acid hydrochloride
• CAS No.: 270062-89-0
• Molecular Formula: C11H15NO2^.HCl
• Molecular Weight: 229.7
• DSSTox Substance ID: DTXSID30375839
• Mol file: 270062-89-0.mol

Synonyms:270062-89-0;(S)-3-AMINO-4-(2-METHYLPHENYL)BUTANOIC ACID HYDROCHLORIDE;331763-79-2;(S)-3-amino-4-(o-tolyl)butanoic acid hydrochloride;(S)-3-AMINO-4-(2-METHYLPHENYL)-BUTYRIC ACID-HCL;(3S)-3-amino-4-(2-methylphenyl)butanoic Acid Hydrochloride;(3S)-3-amino-4-(2-methylphenyl)butanoic acid;hydrochloride;(S)-3-Amino-4-(2-methylphenyl)butanoic acid HCl;(S)-3-Amino-4-(2-methyl-phenyl)-butyric acid-HCl;2-Methyl-L-beta-homophenylalanine hydrochloride;DTXSID30375839;H-Phe(2-Me)-(C#CH2)OH.HCl;MFCD01861019;AKOS025401565;FD10077;AC-22222;AS-48797;CS-0323529;(s)-3-amino-4-(2-methylphenyl)butyric acid hcl;(S)-3-amino-4-(o-tolyl)butanoicacidhydrochloride;(S)-3-amino-4-o-tolylbutanoic acid hydrochloride;(3S)-3-Amino-4-(2-methylphenyl)butanoic acid--hydrogen chloride (1/1)

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

Chemical Property:

• Vapor Pressure: 1.99E-05mmHg at 25°C
• Boiling Point: 347.7 °C at 760 mmHg
• PKA: 3.78±0.10(Predicted)
• Flash Point: 164.1 °C
• PSA: 63.32000
• Density: 1.135±0.06 g/cm3(Predicted)
• LogP: 2.84180
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 229.0869564
• Heavy Atom Count: 15
• Complexity: 194

Purity/Quality:

98%min ^*data from raw suppliers

2-Methyl-L-beta-homophenylalanine hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1CC(CC(=O)O)N.Cl
• Isomeric SMILES: CC1=CC=CC=C1C[C@@H](CC(=O)O)N.Cl