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ChemSpider 2D Image | Methyl (5-methoxy-1,2,4-triazolidin-3-yl)carbamate | C5H12N4O3

Methyl (5-methoxy-1,2,4-triazolidin-3-yl)carbamate

  • Molecular FormulaC5H12N4O3
  • Average mass176.174 Da
  • Monoisotopic mass176.090942 Da
  • ChemSpider ID61027053

More details:






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

(5-Méthoxy-1,2,4-triazolidin-3-yl)carbamate de méthyle [French] [ACD/IUPAC Name]
Carbamic acid, N-(5-methoxy-1,2,4-triazolidin-3-yl)-, methyl ester [ACD/Index Name]
Methyl (5-methoxy-1,2,4-triazolidin-3-yl)carbamate [ACD/IUPAC Name]
Methyl-(5-methoxy-1,2,4-triazolidin-3-yl)carbamat [German] [ACD/IUPAC Name]
1448305-74-5 [RN]
MFCD25988307

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

Density: 1.3±0.1 g/cm3
Boiling Point: 308.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.0±3.0 kJ/mol
Flash Point: 140.6±27.9 °C
Index of Refraction: 1.523
Molar Refractivity: 41.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.36
ACD/LogD (pH 5.5): -2.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.31
Polar Surface Area: 84 Å2
Polarizability: 16.4±0.5 10-24cm3
Surface Tension: 47.9±5.0 dyne/cm
Molar Volume: 135.1±5.0 cm3

Click to predict properties on the Chemicalize site






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