ChemSpider 2D Image | tert-butyl N-(2-methyl-5-nitropyrazol-3-yl)carbamate | C9H14N4O4

tert-butyl N-(2-methyl-5-nitropyrazol-3-yl)carbamate

  • Molecular FormulaC9H14N4O4
  • Average mass242.232 Da
  • Monoisotopic mass242.101501 Da
  • ChemSpider ID37994355

More details:

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

(1-Méthyl-3-nitro-1H-pyrazol-5-yl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (1-methyl-3-nitro-1H-pyrazol-5-yl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(1-methyl-3-nitro-1H-pyrazol-5-yl)carbamat [German] [ACD/IUPAC Name]
948573-72-6 [RN]
Carbamic acid, N-(1-methyl-3-nitro-1H-pyrazol-5-yl)-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-butyl N-(1-methyl-3-nitro-1H-pyrazol-5-yl)carbamate
tert-butyl N-(2-methyl-5-nitropyrazol-3-yl)carbamate
MFCD28400144
tert-butyl (1-methyl-3-nitro-1H-pyrazol-5-yl)carbamate
tert-butyl 1-methyl-3-nitro-1H-pyrazol-5-ylcarbamate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 323.0±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.5±3.0 kJ/mol
Flash Point: 149.1±23.7 °C
Index of Refraction: 1.571
Molar Refractivity: 59.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.97
ACD/LogD (pH 5.5): 1.59
ACD/BCF (pH 5.5): 9.49
ACD/KOC (pH 5.5): 174.23
ACD/LogD (pH 7.4): 1.59
ACD/BCF (pH 7.4): 9.49
ACD/KOC (pH 7.4): 174.23
Polar Surface Area: 102 Å2
Polarizability: 23.5±0.5 10-24cm3
Surface Tension: 48.5±7.0 dyne/cm
Molar Volume: 180.3±7.0 cm3

Click to predict properties on the Chemicalize site


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