ChemSpider 2D Image | 2-(~15~N)Amino-4-(2-aminophenyl)-4-oxo(1,2-~13~C_2_)butanoic acid | C813C2H12N15NO3

2-(15N)Amino-4-(2-aminophenyl)-4-oxo(1,2-13C2)butanoic acid

  • Molecular FormulaC813C2H12N15NO3
  • Average mass211.193 Da
  • Monoisotopic mass211.088531 Da
  • ChemSpider ID48060154
  • Non-standard isotope - Non-standard isotope

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-(15N)Amino-4-(2-aminophenyl)-4-oxo(1,2-13C2)butanoic acid [ACD/IUPAC Name]
2-(15N)Amino-4-(2-aminophenyl)-4-oxo(1,2-13C2)butansäure [German] [ACD/IUPAC Name]
Acide 2-(15N)amino-4-(2-aminophényl)-4-oxo(1,2-13C2)butanoïque [French] [ACD/IUPAC Name]
Benzenebutanoic-α,carboxy-13C2 acid, 2-amino-α-(amino-15N)-γ-oxo- [ACD/Index Name]
1391051-69-6 [RN]
4-(2-aminophenyl)-2-azanyl-4-oxobutanoic acid
rac Kynurenine-13C2,15N

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.626
Molar Refractivity: 54.8±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 68.7±3.0 dyne/cm
Molar Volume: 154.9±3.0 cm3

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