ChemSpider 2D Image | 2-Amino-5-(dimethylcarbamoyl)-4-methyl-3-thiophenecarboxylic acid | C9H12N2O3S

2-Amino-5-(dimethylcarbamoyl)-4-methyl-3-thiophenecarboxylic acid

  • Molecular FormulaC9H12N2O3S
  • Average mass228.268 Da
  • Monoisotopic mass228.056870 Da
  • ChemSpider ID103846689

More details:

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

2-Amino-5-(dimethylcarbamoyl)-4-methyl-3-thiophencarbonsäure [German] [ACD/IUPAC Name]
2-Amino-5-(dimethylcarbamoyl)-4-methyl-3-thiophenecarboxylic acid [ACD/IUPAC Name]
3-Thiophenecarboxylic acid, 2-amino-5-[(dimethylamino)carbonyl]-4-methyl- [ACD/Index Name]
Acide 2-amino-5-(diméthylcarbamoyl)-4-méthyl-3-thiophènecarboxylique [French] [ACD/IUPAC Name]
2-amino-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylic acid
MFCD30343574

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

Density: 1.4±0.1 g/cm3
Boiling Point: 495.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.3±3.0 kJ/mol
Flash Point: 253.3±28.7 °C
Index of Refraction: 1.633
Molar Refractivity: 59.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.39
ACD/LogD (pH 5.5): 0.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.21
ACD/LogD (pH 7.4): -1.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 112 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 63.6±3.0 dyne/cm
Molar Volume: 165.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement