ChemSpider 2D Image | 4-chloro-5-[4-(2,6-dichlorobenzenesulfonyl)piperazin-1-yl]-1-benzofuran-2-carboxylic acid | C19H15Cl3N2O5S

4-chloro-5-[4-(2,6-dichlorobenzenesulfonyl)piperazin-1-yl]-1-benzofuran-2-carboxylic acid

  • Molecular FormulaC19H15Cl3N2O5S
  • Average mass489.757 Da
  • Monoisotopic mass487.976715 Da
  • ChemSpider ID88296852

More details:

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

1192171-69-9 [RN]
2-Benzofurancarboxylic acid, 4-chloro-5-[4-[(2,6-dichlorophenyl)sulfonyl]-1-piperazinyl]- [ACD/Index Name]
4-Chlor-5-{4-[(2,6-dichlorphenyl)sulfonyl]-1-piperazinyl}-1-benzofuran-2-carbonsäure [German] [ACD/IUPAC Name]
4-chloro-5-[4-(2,6-dichlorobenzenesulfonyl)piperazin-1-yl]-1-benzofuran-2-carboxylic acid
4-Chloro-5-{4-[(2,6-dichlorophenyl)sulfonyl]-1-piperazinyl}-1-benzofuran-2-carboxylic acid [ACD/IUPAC Name]
Acide 4-chloro-5-{4-[(2,6-dichlorophényl)sulfonyl]-1-pipérazinyl}-1-benzofurane-2-carboxylique [French] [ACD/IUPAC Name]
2156704-25-3 [RN]
4-chloro-5-[4-(2,6-dichlorophenyl)sulfonylpiperazin-1-yl]-1-benzofuran-2-carboxylic acid
MFCD32701906
Vonafexor

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

Density: 1.6±0.1 g/cm3
Boiling Point: 680.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.9±3.0 kJ/mol
Flash Point: 365.3±34.3 °C
Index of Refraction: 1.680
Molar Refractivity: 115.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.58
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 99 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 66.7±3.0 dyne/cm
Molar Volume: 305.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement