ChemSpider 2D Image | 2-Nitrophenyl N~2~-{[(2-methyl-2-propanyl)oxy]carbonyl}asparaginate | C15H19N3O7

2-Nitrophenyl N2-{[(2-methyl-2-propanyl)oxy]carbonyl}asparaginate

  • Molecular FormulaC15H19N3O7
  • Average mass353.327 Da
  • Monoisotopic mass353.122314 Da
  • ChemSpider ID28562009

More details:

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

2-Nitrophenyl N2-{[(2-methyl-2-propanyl)oxy]carbonyl}asparaginate [ACD/IUPAC Name]
2-Nitrophenyl-N2-{[(2-methyl-2-propanyl)oxy]carbonyl}asparaginat [German] [ACD/IUPAC Name]
Asparagine, N2-[(1,1-dimethylethoxy)carbonyl]-, 2-nitrophenyl ester [ACD/Index Name]
N2-{[(2-Méthyl-2-propanyl)oxy]carbonyl}asparaginate de 2-nitrophényle [French] [ACD/IUPAC Name]
2-NITROPHENYL 2-[(TERT-BUTOXYCARBONYL)AMINO]-3-CARBAMOYLPROPANOATE
38605-58-2 [RN]
MFCD00076909
Nα-BOC-L-ASPARAGINE 2-NITROPHENYL ESTER

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 603.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.7±3.0 kJ/mol
Flash Point: 318.5±31.5 °C
Index of Refraction: 1.550
Molar Refractivity: 85.4±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 2.11
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 12.35
ACD/KOC (pH 5.5): 210.36
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 12.34
ACD/KOC (pH 7.4): 210.18
Polar Surface Area: 154 Å2
Polarizability: 33.9±0.5 10-24cm3
Surface Tension: 52.7±3.0 dyne/cm
Molar Volume: 268.0±3.0 cm3

Click to predict properties on the Chemicalize site


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