ChemSpider 2D Image | N-[4-(4-nitrophenylphospho)butanoyl]-D-alanine | C13H17N2O8P

N-[4-(4-nitrophenylphospho)butanoyl]-D-alanine

  • Molecular FormulaC13H17N2O8P
  • Average mass360.256 Da
  • Monoisotopic mass360.072266 Da
  • ChemSpider ID26331664

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Alanine, N-[4-[hydroxy(4-nitrophenoxy)phosphinyl]-1-oxobutyl]- [ACD/Index Name]
N-[4-(4-nitrophenylphospho)butanoyl]-D-alanine
N-[4-(4-nitrophenylphospho)butanoyl]-L-alanine
N-{4-[Hydroxy(4-nitrophenoxy)phosphoryl]butanoyl}-D-alanin [German] [ACD/IUPAC Name]
N-{4-[Hydroxy(4-nitrophenoxy)phosphoryl]butanoyl}-D-alanine [ACD/IUPAC Name]
N-{4-[Hydroxy(4-nitrophénoxy)phosphoryl]butanoyl}-D-alanine [French] [ACD/IUPAC Name]
N-[4-(4-nitrophenylphospho)butyryl]-D-alanine
N-[4-(4-nitrophenylphospho)butyryl]-L-alanine
PARA-NITROPHENYL PHOSPHONOBUTANOYL D-ALANINE
p-nitrophenyl phosphonobutanoyl D-alanine
More...

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

9151197 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.568
Molar Refractivity: 80.8±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: -0.26
ACD/LogD (pH 5.5): -5.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 169 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 64.3±3.0 dyne/cm
Molar Volume: 246.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement