ChemSpider 2D Image | 2-(5-bromo-2-chlorophenyl)-5-{[(tert-butoxy)carbonyl]amino}-1,3-thiazole-4-carboxylic acid | C15H14BrClN2O4S

2-(5-bromo-2-chlorophenyl)-5-{[(tert-butoxy)carbonyl]amino}-1,3-thiazole-4-carboxylic acid

  • Molecular FormulaC15H14BrClN2O4S
  • Average mass433.705 Da
  • Monoisotopic mass431.954620 Da
  • ChemSpider ID57379829

More details:

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

1270034-28-0 [RN]
2-(5-Brom-2-chlorphenyl)-5-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1,3-thiazol-4-carbonsäure [German] [ACD/IUPAC Name]
2-(5-Bromo-2-chlorophenyl)-5-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1,3-thiazole-4-carboxylic acid [ACD/IUPAC Name]
2-(5-bromo-2-chlorophenyl)-5-{[(tert-butoxy)carbonyl]amino}-1,3-thiazole-4-carboxylic acid
4-Thiazolecarboxylic acid, 2-(5-bromo-2-chlorophenyl)-5-[[(1,1-dimethylethoxy)carbonyl]amino]- [ACD/Index Name]
Acide 2-(5-bromo-2-chlorophényl)-5-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-1,3-thiazole-4-carboxylique [French] [ACD/IUPAC Name]
2-(5-Bromo-2-chlorophenyl)-5-((tert-butoxycarbonyl)amino)thiazole-4-carboxylic acid
5-(Boc-amino)-2-(5-bromo-2-chlorophenyl)thiazole-4-carboxylic acid
MFCD21607183

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.644
Molar Refractivity: 96.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.90
ACD/LogD (pH 5.5): 2.66
ACD/BCF (pH 5.5): 16.45
ACD/KOC (pH 5.5): 53.65
ACD/LogD (pH 7.4): 1.94
ACD/BCF (pH 7.4): 3.11
ACD/KOC (pH 7.4): 10.13
Polar Surface Area: 117 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 60.3±3.0 dyne/cm
Molar Volume: 267.1±3.0 cm3

Click to predict properties on the Chemicalize site


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