Found 53 results

Search term: MF = 'C_{21}H_{19}NO_{7}S_{2}'
ChemSpider 2D Image | (4-{[(2,5-Dimethoxyphenyl)sulfonyl](2-thienylcarbonyl)amino}phenyl)acetic acid | C21H19NO7S2

(4-{[(2,5-Dimethoxyphenyl)sulfonyl](2-thienylcarbonyl)amino}phenyl)acetic acid

  • Molecular FormulaC21H19NO7S2
  • Average mass461.508 Da
  • Monoisotopic mass461.060303 Da
  • ChemSpider ID59082688

More details:

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

(4-{[(2,5-Dimethoxyphenyl)sulfonyl](2-thienylcarbonyl)amino}phenyl)acetic acid [ACD/IUPAC Name]
(4-{[(2,5-Dimethoxyphenyl)sulfonyl](2-thienylcarbonyl)amino}phenyl)essigsäure [German] [ACD/IUPAC Name]
Acide (4-{[(2,5-diméthoxyphényl)sulfonyl](2-thiénylcarbonyl)amino}phényl)acétique [French] [ACD/IUPAC Name]
Benzeneacetic acid, 4-[[(2,5-dimethoxyphenyl)sulfonyl](2-thienylcarbonyl)amino]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 692.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.5±3.0 kJ/mol
Flash Point: 372.5±34.3 °C
Index of Refraction: 1.637
Molar Refractivity: 115.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.09
ACD/LogD (pH 5.5): 1.65
ACD/BCF (pH 5.5): 4.85
ACD/KOC (pH 5.5): 42.62
ACD/LogD (pH 7.4): -0.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 147 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 62.9±3.0 dyne/cm
Molar Volume: 321.4±3.0 cm3

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