ChemSpider 2D Image | 2-Methyl-2-propanyl (3S)-3-(2,3-dichlorophenyl)-1-piperazinecarboxylate | C15H20Cl2N2O2

2-Methyl-2-propanyl (3S)-3-(2,3-dichlorophenyl)-1-piperazinecarboxylate

  • Molecular FormulaC15H20Cl2N2O2
  • Average mass331.237 Da
  • Monoisotopic mass330.090179 Da
  • ChemSpider ID96441413

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-(2,3-Dichlorophényl)-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1-Piperazinecarboxylic acid, 3-(2,3-dichlorophenyl)-, 1,1-dimethylethyl ester, (3S)- [ACD/Index Name]
2-Methyl-2-propanyl (3S)-3-(2,3-dichlorophenyl)-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3S)-3-(2,3-dichlorphenyl)-1-piperazincarboxylat [German] [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: 409.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.1±3.0 kJ/mol
Flash Point: 201.3±28.7 °C
Index of Refraction: 1.541
Molar Refractivity: 84.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.24
ACD/LogD (pH 5.5): 2.25
ACD/BCF (pH 5.5): 12.60
ACD/KOC (pH 5.5): 75.87
ACD/LogD (pH 7.4): 3.66
ACD/BCF (pH 7.4): 323.71
ACD/KOC (pH 7.4): 1949.69
Polar Surface Area: 42 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 268.8±3.0 cm3

Click to predict properties on the Chemicalize site


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