ChemSpider 2D Image | 2-Methyl-2-propanyl 4-[2-({2-[(2-ethoxy-2-oxoethyl)carbamoyl]hydrazino}carbonyl)-4-nitrophenyl]-1-piperazinecarboxylate | C21H30N6O8

2-Methyl-2-propanyl 4-[2-({2-[(2-ethoxy-2-oxoethyl)carbamoyl]hydrazino}carbonyl)-4-nitrophenyl]-1-piperazinecarboxylate

  • Molecular FormulaC21H30N6O8
  • Average mass494.498 Da
  • Monoisotopic mass494.212524 Da
  • ChemSpider ID102243346

More details:

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

1-Piperazinecarboxylic acid, 4-[2-[[2-[[(2-ethoxy-2-oxoethyl)amino]carbonyl]hydrazinyl]carbonyl]-4-nitrophenyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-[2-({2-[(2-ethoxy-2-oxoethyl)carbamoyl]hydrazino}carbonyl)-4-nitrophenyl]-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[2-({2-[(2-ethoxy-2-oxoethyl)carbamoyl]hydrazino}carbonyl)-4-nitrophenyl]-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-[2-({2-[(2-Éthoxy-2-oxoéthyl)carbamoyl]hydrazino}carbonyl)-4-nitrophényl]-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.565
Molar Refractivity: 122.5±0.3 cm3
#H bond acceptors: 14
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 1.58
ACD/LogD (pH 5.5): 1.17
ACD/BCF (pH 5.5): 4.59
ACD/KOC (pH 5.5): 103.57
ACD/LogD (pH 7.4): 1.16
ACD/BCF (pH 7.4): 4.48
ACD/KOC (pH 7.4): 101.04
Polar Surface Area: 175 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 55.1±3.0 dyne/cm
Molar Volume: 376.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement