ChemSpider 2D Image | 2-[4-(4-Acetylphenyl)-1-piperazinyl]-2-oxoethyl 4-(4-acetylphenyl)-1-piperazinecarbodithioate | C27H32N4O3S2

2-[4-(4-Acetylphenyl)-1-piperazinyl]-2-oxoethyl 4-(4-acetylphenyl)-1-piperazinecarbodithioate

  • Molecular FormulaC27H32N4O3S2
  • Average mass524.698 Da
  • Monoisotopic mass524.191589 Da
  • ChemSpider ID32082885

More details:

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

1-Piperazinecarbodithioic acid, 4-(4-acetylphenyl)-, 2-[4-(4-acetylphenyl)-1-piperazinyl]-2-oxoethyl ester [ACD/Index Name]
2-[4-(4-Acetylphenyl)-1-piperazinyl]-2-oxoethyl 4-(4-acetylphenyl)-1-piperazinecarbodithioate [ACD/IUPAC Name]
2-[4-(4-Acetylphenyl)-1-piperazinyl]-2-oxoethyl-4-(4-acetylphenyl)-1-piperazincarbodithioat [German] [ACD/IUPAC Name]
4-(4-Acétylphényl)-1-pipérazinecarbodithioate de 2-[4-(4-acétylphényl)-1-pipérazinyl]-2-oxoéthyle [French] [ACD/IUPAC Name]
2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl 4-(4-acetylphenyl)piperazine-1-carbodithioate
MFCD28165677

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

Density: 1.3±0.1 g/cm3
Boiling Point: 761.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 110.9±3.0 kJ/mol
Flash Point: 414.1±35.7 °C
Index of Refraction: 1.641
Molar Refractivity: 147.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.30
ACD/LogD (pH 5.5): 2.67
ACD/BCF (pH 5.5): 63.20
ACD/KOC (pH 5.5): 676.86
ACD/LogD (pH 7.4): 2.67
ACD/BCF (pH 7.4): 63.22
ACD/KOC (pH 7.4): 677.15
Polar Surface Area: 122 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 60.1±3.0 dyne/cm
Molar Volume: 407.9±3.0 cm3

Click to predict properties on the Chemicalize site


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