ChemSpider 2D Image | 3-Ethyl-6-{[(4-fluorophenyl)sulfonyl]amino}-2-methylbenzoic acid | C16H16FNO4S

3-Ethyl-6-{[(4-fluorophenyl)sulfonyl]amino}-2-methylbenzoic acid

  • Molecular FormulaC16H16FNO4S
  • Average mass337.366 Da
  • Monoisotopic mass337.078400 Da
  • ChemSpider ID22377130

More details:

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

3-Ethyl-6-{[(4-fluorophenyl)sulfonyl]amino}-2-methylbenzoic acid [ACD/IUPAC Name]
3-Ethyl-6-{[(4-fluorphenyl)sulfonyl]amino}-2-methylbenzoesäure [German] [ACD/IUPAC Name]
Acide 3-éthyl-6-{[(4-fluorophényl)sulfonyl]amino}-2-méthylbenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-ethyl-6-[[(4-fluorophenyl)sulfonyl]amino]-2-methyl- [ACD/Index Name]
3-ethyl-6-(4-fluorobenzenesulfonamido)-2-methylbenzoic acid
3-ethyl-6-[(4-fluorobenzene)sulfonamido]-2-methylbenzoic acid
5,6-disubstituted anthranilic acid sulfonamide, 9c
F77

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

Density: 1.4±0.1 g/cm3
Boiling Point: 491.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.8±3.0 kJ/mol
Flash Point: 250.9±31.5 °C
Index of Refraction: 1.605
Molar Refractivity: 84.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.14
ACD/LogD (pH 5.5): 1.67
ACD/BCF (pH 5.5): 2.06
ACD/KOC (pH 5.5): 8.09
ACD/LogD (pH 7.4): 1.51
ACD/BCF (pH 7.4): 1.43
ACD/KOC (pH 7.4): 5.63
Polar Surface Area: 92 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 244.4±3.0 cm3

Click to predict properties on the Chemicalize site


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