ChemSpider 2D Image | 2-Methyl-2-propanyl 3-(2-chlorophenyl)-4-{4-[2-(mesitylamino)-2-oxoethoxy]-3-methoxybenzyl}-1-piperazinecarboxylate | C34H42ClN3O5

2-Methyl-2-propanyl 3-(2-chlorophenyl)-4-{4-[2-(mesitylamino)-2-oxoethoxy]-3-methoxybenzyl}-1-piperazinecarboxylate

  • Molecular FormulaC34H42ClN3O5
  • Average mass608.167 Da
  • Monoisotopic mass607.281311 Da
  • ChemSpider ID128662600

More details:

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

1-Piperazinecarboxylic acid, 3-(2-chlorophenyl)-4-[[3-methoxy-4-[2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethoxy]phenyl]methyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-(2-chlorophenyl)-4-{4-[2-(mesitylamino)-2-oxoethoxy]-3-methoxybenzyl}-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-(2-chlorphenyl)-4-{4-[2-(mesitylamino)-2-oxoethoxy]-3-methoxybenzyl}-1-piperazincarboxylat [German] [ACD/IUPAC Name]
3-(2-Chlorophényl)-4-{4-[2-(mésitylamino)-2-oxoéthoxy]-3-méthoxybenzyl}-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: 1.2±0.1 g/cm3
Boiling Point: 693.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.6±3.0 kJ/mol
Flash Point: 373.1±31.5 °C
Index of Refraction: 1.591
Molar Refractivity: 170.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.43
ACD/LogD (pH 5.5): 6.20
ACD/BCF (pH 5.5): 27612.27
ACD/KOC (pH 5.5): 46809.23
ACD/LogD (pH 7.4): 6.38
ACD/BCF (pH 7.4): 41207.51
ACD/KOC (pH 7.4): 69856.34
Polar Surface Area: 80 Å2
Polarizability: 67.6±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 504.5±3.0 cm3

Click to predict properties on the Chemicalize site


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