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82372-74-5

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Basic Information
CAS No.: 82372-74-5
Name: L-4-TERT-BUTYL-PHE
Article Data: 3
Molecular Structure:
Molecular Structure of 82372-74-5 (L-4-TERT-BUTYL-PHE)
Formula: C13H19 N O2
Molecular Weight: 221.299
Synonyms: p-tert-Butylphenylalanine
Density: 1.084g/cm3
Boiling Point: 347.5oC at 760 mmHg
Flash Point: 164oC
Hazard Symbols: Xi
PSA: 63.32000
LogP: 2.63880
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Chemistry

Product Name: L-Phenylalanine,4-(1,1-dimethylethyl)- (CAS NO.82372-74-5)

Molecular Formula: C13H19NO2
Molecular Weight: 221.3g/mol
Mol File: 82372-74-5.mol
Storage Temperature: Store at RT.
Index of Refraction: 1.538 
Molar Refractivity: 63.88 cm3 
Molar Volume: 204.1 cm3 
Surface Tension: 42 dyne/cm 
Density: 1.084 g/cm3 
Flash Point: 164 °C 
Enthalpy of Vaporization: 62.45 kJ/mol 
Boiling Point: 347.5 °C at 760 mmHg 
Vapour Pressure: 2.02E-05 mmHg at 25°C 
XLogP3-AA: 0.2
H-Bond Donor: 2
H-Bond Acceptor: 3
Structure Descriptors of L-Phenylalanine,4-(1,1-dimethylethyl)- (CAS NO.82372-74-5):
  IUPAC Name: (2S)-2-amino-3-(4-tert-butylphenyl)propanoic acid
  Canonical SMILES: CC(C)(C)C1=CC=C(C=C1)CC(C(=O)O)N
  Isomeric SMILES: CC(C)(C)C1=CC=C(C=C1)C[C@@H](C(=O)O)N
  InChI: InChI=1S/C13H19NO2/c1-13(2,3)10-6-4-9(5-7-10)8-11(14)12(15)16/h4-7,11H,
8,14H2,1-3H3,(H,15,16)/t11-/m0/s1    InChIKey: CSJZKSXYLTYFPU-NSHDSACASA-N
Product Categories: Phenylalanine analogs and other aromatic alpha amino acids

Safety Profile

Safety Information of L-Phenylalanine,4-(1,1-dimethylethyl)- (CAS NO.82372-74-5):
Hazard Codes: XiIrritant

Specification

 L-Phenylalanine,4-(1,1-dimethylethyl)- , its CAS NO. is 82372-74-5, the synonym is 2-amino-3-(4-tert-butylphenyl)propanoic Acid .