Found 156 results

Search term: MF = 'C_{6}H_{4}N_{2}O_{2}S'
ChemSpider 2D Image | 2-(cyanomethyl)thiazole-4-carboxylic acid | C6H4N2O2S

2-(cyanomethyl)thiazole-4-carboxylic acid

  • Molecular FormulaC6H4N2O2S
  • Average mass168.173 Da
  • Monoisotopic mass167.999344 Da
  • ChemSpider ID24188707

More details:

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

2-(Cyanmethyl)-1,3-thiazol-4-carbonsäure [German] [ACD/IUPAC Name]
2-(Cyanomethyl)-1,3-thiazole-4-carboxylic acid [ACD/IUPAC Name]
2-(cyanomethyl)thiazole-4-carboxylic acid
439905-17-6 [RN]
4-Thiazolecarboxylic acid, 2-(cyanomethyl)- [ACD/Index Name]
Acide 2-(cyanométhyl)-1,3-thiazole-4-carboxylique [French] [ACD/IUPAC Name]
2-cyanomethylthiazole-4-carboxylic acid
4-THIAZOLECARBOXYLIC ACID 2-(CYANOMETHYL)-
4-Thiazolecarboxylic acid, 2-(cyanomethyl)- (9CI)
4-thiazolecarboxylic acid,2-(cyanomethyl)-
More...

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

Density: 1.5±0.1 g/cm3
Boiling Point: 405.4±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.3±3.0 kJ/mol
Flash Point: 199.0±23.2 °C
Index of Refraction: 1.624
Molar Refractivity: 39.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.25
ACD/LogD (pH 5.5): -1.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 80.0±3.0 dyne/cm
Molar Volume: 110.9±3.0 cm3

Click to predict properties on the Chemicalize site


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