ChemSpider 2D Image | 5-[(4-Methylphenyl)sulfonyl]-2-thiophenecarboxylic acid | C12H10O4S2

5-[(4-Methylphenyl)sulfonyl]-2-thiophenecarboxylic acid

  • Molecular FormulaC12H10O4S2
  • Average mass282.335 Da
  • Monoisotopic mass282.002045 Da
  • ChemSpider ID24793525

More details:

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

2-Thiophenecarboxylic acid, 5-[(4-methylphenyl)sulfonyl]- [ACD/Index Name]
5-[(4-Methylphenyl)sulfonyl]-2-thiophencarbonsäure [German] [ACD/IUPAC Name]
5-[(4-Methylphenyl)sulfonyl]-2-thiophenecarboxylic acid [ACD/IUPAC Name]
Acide 5-[(4-méthylphényl)sulfonyl]-2-thiophènecarboxylique [French] [ACD/IUPAC Name]
1171239-09-0 [RN]
5-(4-methylbenzenesulfonyl)thiophene-2-carboxylic acid
5-[(4-methylphenyl)sulfonyl]thiophene-2-carboxylic acid
MFCD13187149
NS-04660

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

Density: 1.4±0.1 g/cm3
Boiling Point: 523.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.9±3.0 kJ/mol
Flash Point: 270.4±28.7 °C
Index of Refraction: 1.625
Molar Refractivity: 69.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.53
ACD/LogD (pH 5.5): 0.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.84
ACD/LogD (pH 7.4): -0.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 108 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 57.8±3.0 dyne/cm
Molar Volume: 196.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement