ChemSpider 2D Image | Methyl 3-[(4-nitro-1H-pyrazol-1-yl)acetyl]-1,3-thiazolidine-4-carboxylate | C10H12N4O5S

Methyl 3-[(4-nitro-1H-pyrazol-1-yl)acetyl]-1,3-thiazolidine-4-carboxylate

  • Molecular FormulaC10H12N4O5S
  • Average mass300.291 Da
  • Monoisotopic mass300.052826 Da
  • ChemSpider ID65055775

More details:

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

3-[2-(4-Nitro-1H-pyrazol-1-yl)acétyl]-1,3-thiazolidine-4-carboxylate de méthyle [French] [ACD/IUPAC Name]
4-Thiazolidinecarboxylic acid, 3-[2-(4-nitro-1H-pyrazol-1-yl)acetyl]-, methyl ester [ACD/Index Name]
Methyl 3-[(4-nitro-1H-pyrazol-1-yl)acetyl]-1,3-thiazolidine-4-carboxylate [ACD/IUPAC Name]
Methyl-3-[(4-nitro-1H-pyrazol-1-yl)acetyl]-1,3-thiazolidin-4-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 535.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 277.7±30.1 °C
Index of Refraction: 1.702
Molar Refractivity: 70.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.55
ACD/LogD (pH 5.5): 0.46
ACD/BCF (pH 5.5): 1.31
ACD/KOC (pH 5.5): 42.19
ACD/LogD (pH 7.4): 0.46
ACD/BCF (pH 7.4): 1.31
ACD/KOC (pH 7.4): 42.19
Polar Surface Area: 136 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 74.0±7.0 dyne/cm
Molar Volume: 183.0±7.0 cm3

Click to predict properties on the Chemicalize site


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