ChemSpider 2D Image | 2-{[(4-Methylphenyl)sulfonyl]amino}-4-phenoxybenzoic acid | C20H17NO5S

2-{[(4-Methylphenyl)sulfonyl]amino}-4-phenoxybenzoic acid

  • Molecular FormulaC20H17NO5S
  • Average mass383.418 Da
  • Monoisotopic mass383.082733 Da
  • ChemSpider ID30810960

More details:

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

2-{[(4-Methylphenyl)sulfonyl]amino}-4-phenoxybenzoesäure [German] [ACD/IUPAC Name]
2-{[(4-Methylphenyl)sulfonyl]amino}-4-phenoxybenzoic acid [ACD/IUPAC Name]
Acide 2-{[(4-méthylphényl)sulfonyl]amino}-4-phénoxybenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-[[(4-methylphenyl)sulfonyl]amino]-4-phenoxy- [ACD/Index Name]
1JL

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

Density: 1.4±0.1 g/cm3
Boiling Point: 555.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.1±3.0 kJ/mol
Flash Point: 290.0±32.9 °C
Index of Refraction: 1.649
Molar Refractivity: 101.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.50
ACD/LogD (pH 5.5): 3.06
ACD/BCF (pH 5.5): 42.72
ACD/KOC (pH 5.5): 144.02
ACD/LogD (pH 7.4): 1.79
ACD/BCF (pH 7.4): 2.30
ACD/KOC (pH 7.4): 7.76
Polar Surface Area: 101 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 60.9±3.0 dyne/cm
Molar Volume: 277.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement