ChemSpider 2D Image | 1-[(4-Chloro-2-nitrophenyl)sulfonyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazine | C14H16ClN5O5S

1-[(4-Chloro-2-nitrophenyl)sulfonyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazine

  • Molecular FormulaC14H16ClN5O5S
  • Average mass401.825 Da
  • Monoisotopic mass401.056061 Da
  • ChemSpider ID32024014

More details:

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

1-[(4-Chlor-2-nitrophenyl)sulfonyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazin [German] [ACD/IUPAC Name]
1-[(4-Chloro-2-nitrophenyl)sulfonyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazine [ACD/IUPAC Name]
1-[(4-Chloro-2-nitrophényl)sulfonyl]-4-[(5-méthyl-1,2,4-oxadiazol-3-yl)méthyl]pipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-[(4-chloro-2-nitrophenyl)sulfonyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 576.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.3±3.0 kJ/mol
Flash Point: 302.4±32.9 °C
Index of Refraction: 1.621
Molar Refractivity: 92.7±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 2.59
ACD/LogD (pH 5.5): 2.05
ACD/BCF (pH 5.5): 21.32
ACD/KOC (pH 5.5): 310.64
ACD/LogD (pH 7.4): 2.05
ACD/BCF (pH 7.4): 21.40
ACD/KOC (pH 7.4): 311.78
Polar Surface Area: 134 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 69.1±3.0 dyne/cm
Molar Volume: 263.5±3.0 cm3

Click to predict properties on the Chemicalize site


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