ChemSpider 2D Image | 2-(Allylcarbamoyl)-1,3-thiazole-4-carboxylic acid | C8H8N2O3S

2-(Allylcarbamoyl)-1,3-thiazole-4-carboxylic acid

  • Molecular FormulaC8H8N2O3S
  • Average mass212.226 Da
  • Monoisotopic mass212.025558 Da
  • ChemSpider ID26053504

More details:






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

1258650-46-2 [RN]
2-(Allylcarbamoyl)-1,3-thiazol-4-carbonsäure [German] [ACD/IUPAC Name]
2-(Allylcarbamoyl)-1,3-thiazole-4-carboxylic acid [ACD/IUPAC Name]
2-[(prop-2-en-1-yl)carbamoyl]-1,3-thiazole-4-carboxylic acid
4-Thiazolecarboxylic acid, 2-[(2-propen-1-ylamino)carbonyl]- [ACD/Index Name]
Acide 2-(allylcarbamoyl)-1,3-thiazole-4-carboxylique [French] [ACD/IUPAC Name]
MFCD17167176 [MDL number]
2-(allylcarbamoyl)thiazole-4-carboxylic acid

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.598
Molar Refractivity: 52.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.69
ACD/LogD (pH 5.5): -1.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 108 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 61.3±3.0 dyne/cm
Molar Volume: 153.1±3.0 cm3

Click to predict properties on the Chemicalize site






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