ChemSpider 2D Image | METHYL 2-AMINOBENZO[D]THIAZOLE-5-CARBOXYLATE | C9H8N2O2S

METHYL 2-AMINOBENZO[D]THIAZOLE-5-CARBOXYLATE

  • Molecular FormulaC9H8N2O2S
  • Average mass208.237 Da
  • Monoisotopic mass208.030655 Da
  • ChemSpider ID13360277

More details:






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

209459-07-4 [RN]
2-Amino-1,3-benzothiazole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
5-Benzothiazolecarboxylic acid, 2-amino-, methyl ester [ACD/Index Name]
Methyl 2-amino-1,3-benzothiazole-5-carboxylate [ACD/IUPAC Name]
METHYL 2-AMINOBENZO[D]THIAZOLE-5-CARBOXYLATE
Methyl-2-amino-1,3-benzothiazol-5-carboxylat [German] [ACD/IUPAC Name]
MFCD09263763 [MDL number]
[209459-07-4]
23616-33-3 [RN]
2-amino benzothiazole-5-carboxylic acid methyl ester
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 378.4±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.6±3.0 kJ/mol
Flash Point: 182.6±25.7 °C
Index of Refraction: 1.700
Molar Refractivity: 56.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.87
ACD/LogD (pH 5.5): 1.69
ACD/BCF (pH 5.5): 11.25
ACD/KOC (pH 5.5): 196.59
ACD/LogD (pH 7.4): 1.69
ACD/BCF (pH 7.4): 11.28
ACD/KOC (pH 7.4): 197.19
Polar Surface Area: 93 Å2
Polarizability: 22.4±0.5 10-24cm3
Surface Tension: 67.1±3.0 dyne/cm
Molar Volume: 146.4±3.0 cm3

Click to predict properties on the Chemicalize site






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