ChemSpider 2D Image | tert-Butyl 3-methoxy-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxylate | C11H18N4O3

tert-Butyl 3-methoxy-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxylate

  • Molecular FormulaC11H18N4O3
  • Average mass254.286 Da
  • Monoisotopic mass254.137894 Da
  • ChemSpider ID21109184

More details:

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

1,2,4-Triazolo[4,3-a]pyrazine-7(8H)-carboxylic acid, 5,6-dihydro-3-methoxy-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-methoxy-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-methoxy-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-carboxylat [German] [ACD/IUPAC Name]
3-Méthoxy-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 3-methoxy-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxylate
723286-81-5 [RN]
7-Boc-3-methoxy-5,6,7,8-tetrahydro-1,2,4-triazolo[4,3-a]pyrazine
MFCD09701970 [MDL number]
tert-butyl 3-methoxy-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxylate
tert-Butyl 3-methoxy-5,6-dihydro-1,2,4triazolo[4,3-a]pyrazine-7(8H)-carboxylate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.3±0.1 g/cm3
Boiling Point: 401.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.2±3.0 kJ/mol
Flash Point: 196.3±31.5 °C
Index of Refraction: 1.584
Molar Refractivity: 65.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.36
ACD/LogD (pH 5.5): 0.88
ACD/BCF (pH 5.5): 2.73
ACD/KOC (pH 5.5): 71.32
ACD/LogD (pH 7.4): 0.88
ACD/BCF (pH 7.4): 2.73
ACD/KOC (pH 7.4): 71.49
Polar Surface Area: 69 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 44.5±7.0 dyne/cm
Molar Volume: 195.9±7.0 cm3

Click to predict properties on the Chemicalize site


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