ChemSpider 2D Image | tert-butyl 3-oxo-2H,5H,7H-pyrrolo[3,4-c]pyridazine-6-carboxylate | C11H15N3O3

tert-butyl 3-oxo-2H,5H,7H-pyrrolo[3,4-c]pyridazine-6-carboxylate

  • Molecular FormulaC11H15N3O3
  • Average mass237.255 Da
  • Monoisotopic mass237.111343 Da
  • ChemSpider ID29339899

More details:

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

1395493-25-0 [RN]
2-Methyl-2-propanyl 3-oxo-2,3,5,7-tetrahydro-6H-pyrrolo[3,4-c]pyridazine-6-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-oxo-2,3,5,7-tetrahydro-6H-pyrrolo[3,4-c]pyridazin-6-carboxylat [German] [ACD/IUPAC Name]
3-Oxo-2,3,5,7-tétrahydro-6H-pyrrolo[3,4-c]pyridazine-6-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
6H-Pyrrolo[3,4-c]pyridazine-6-carboxylic acid, 2,3,5,7-tetrahydro-3-oxo-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-butyl 3-oxo-2H,3H,5H,6H,7H-pyrrolo[3,4-c]pyridazine-6-carboxylate
tert-butyl 3-oxo-2H,5H,7H-pyrrolo[3,4-c]pyridazine-6-carboxylate
tert-Butyl 3-oxo-5,7-dihydro-2H-pyrrolo[3,4-c]pyridazine-6(3H)-carboxylate
3-hydroxy-5,7-dihydro-pyrrolo[3,4-c]pyridazine-6-carboxylic acid tert-butyl ester
3-oxo-2,3,5,7-tetrahydro-pyrrolo[3,4-c]pyridazine-6-carboxylic acid tert-butyl ester
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.610
    Molar Refractivity: 61.3±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.14
    ACD/LogD (pH 5.5): 0.43
    ACD/BCF (pH 5.5): 1.25
    ACD/KOC (pH 5.5): 40.87
    ACD/LogD (pH 7.4): 0.43
    ACD/BCF (pH 7.4): 1.25
    ACD/KOC (pH 7.4): 40.82
    Polar Surface Area: 71 Å2
    Polarizability: 24.3±0.5 10-24cm3
    Surface Tension: 48.3±7.0 dyne/cm
    Molar Volume: 176.7±7.0 cm3

    Click to predict properties on the Chemicalize site


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