ChemSpider 2D Image | tert-butyl 1-methyl-6-(methylcarbamoyl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-2-carboxylate | C15H23N3O3

tert-butyl 1-methyl-6-(methylcarbamoyl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-2-carboxylate

  • Molecular FormulaC15H23N3O3
  • Average mass293.361 Da
  • Monoisotopic mass293.173950 Da
  • ChemSpider ID22370502

More details:

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

1087784-18-6 [RN]
1-Méthyl-6-(méthylcarbamoyl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 1-methyl-6-(methylcarbamoyl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-1-methyl-6-(methylcarbamoyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-carboxylat [German] [ACD/IUPAC Name]
Pyrrolo[1,2-a]pyrazine-2(1H)-carboxylic acid, 3,4-dihydro-1-methyl-6-[(methylamino)carbonyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-butyl 1-methyl-6-(methylcarbamoyl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-2-carboxylate
MFCD11099398 [MDL number]
tert-butyl 1-methyl-6-[(methylamino)carbonyl]-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carboxylate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 460.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.1±3.0 kJ/mol
Flash Point: 232.2±28.7 °C
Index of Refraction: 1.567
Molar Refractivity: 80.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.52
ACD/LogD (pH 5.5): 2.22
ACD/BCF (pH 5.5): 28.83
ACD/KOC (pH 5.5): 386.02
ACD/LogD (pH 7.4): 2.22
ACD/BCF (pH 7.4): 28.83
ACD/KOC (pH 7.4): 386.02
Polar Surface Area: 64 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 40.6±7.0 dyne/cm
Molar Volume: 245.5±7.0 cm3

Click to predict properties on the Chemicalize site


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