ChemSpider 2D Image | 2-(Chlorosulfonyl)isonicotinic acid | C6H4ClNO4S

2-(Chlorosulfonyl)isonicotinic acid

  • Molecular FormulaC6H4ClNO4S
  • Average mass221.618 Da
  • Monoisotopic mass220.954956 Da
  • ChemSpider ID32968873

More details:

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

1314899-09-6 [RN]
2-(Chlorosulfonyl)isonicotinic acid [ACD/IUPAC Name]
2-(chlorosulfonyl)pyridine-4-carboxylic acid
2-(Chlorsulfonyl)isonicotinsäure [German] [ACD/IUPAC Name]
4-Pyridinecarboxylic acid, 2-(chlorosulfonyl)- [ACD/Index Name]
Acide 2-(chlorosulfonyl)isonicotinique [French] [ACD/IUPAC Name]
MFCD19200863

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

Density: 1.7±0.1 g/cm3
Boiling Point: 525.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.2±3.0 kJ/mol
Flash Point: 271.8±25.9 °C
Index of Refraction: 1.590
Molar Refractivity: 44.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.12
ACD/LogD (pH 5.5): -1.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.95
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 93 Å2
Polarizability: 17.6±0.5 10-24cm3
Surface Tension: 67.7±3.0 dyne/cm
Molar Volume: 131.8±3.0 cm3

Click to predict properties on the Chemicalize site


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