ChemSpider 2D Image | tert-butyl 2-methyl-5H,7H,8H-pyrido[4,3-d]pyrimidine-6-carboxylate | C13H19N3O2

tert-butyl 2-methyl-5H,7H,8H-pyrido[4,3-d]pyrimidine-6-carboxylate

  • Molecular FormulaC13H19N3O2
  • Average mass249.309 Da
  • Monoisotopic mass249.147720 Da
  • ChemSpider ID29273416

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

210538-72-0 [RN]
2-Methyl-2-propanyl 2-methyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-methyl-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-carboxylat [German] [ACD/IUPAC Name]
2-Méthyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
MFCD11044688 [MDL number]
Pyrido[4,3-d]pyrimidine-6(5H)-carboxylic acid, 7,8-dihydro-2-methyl-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-butyl 2-methyl-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine-6-carboxylate
tert-butyl 2-methyl-5H,7H,8H-pyrido[4,3-d]pyrimidine-6-carboxylate
tert-Butyl 2-methyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxylate
1,4-DI-TERT-BUTYL PIPERAZINE-1,4-DICARBOXYLATE
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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: 1.1±0.1 g/cm3
    Boiling Point: 361.2±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.7±3.0 kJ/mol
    Flash Point: 172.2±27.9 °C
    Index of Refraction: 1.537
    Molar Refractivity: 67.8±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.68
    ACD/LogD (pH 5.5): 1.87
    ACD/BCF (pH 5.5): 15.42
    ACD/KOC (pH 5.5): 246.50
    ACD/LogD (pH 7.4): 1.87
    ACD/BCF (pH 7.4): 15.44
    ACD/KOC (pH 7.4): 246.82
    Polar Surface Area: 55 Å2
    Polarizability: 26.9±0.5 10-24cm3
    Surface Tension: 47.5±3.0 dyne/cm
    Molar Volume: 217.2±3.0 cm3

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