ChemSpider 2D Image | 2-Methyl-2-propanyl 7-(hydroxymethyl)octahydro-2H-pyrido[1,2-a]pyrazine-2-carboxylate | C14H26N2O3

2-Methyl-2-propanyl 7-(hydroxymethyl)octahydro-2H-pyrido[1,2-a]pyrazine-2-carboxylate

  • Molecular FormulaC14H26N2O3
  • Average mass270.368 Da
  • Monoisotopic mass270.194336 Da
  • ChemSpider ID11426643

More details:

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

2H-Pyrido[1,2-a]pyrazine-2-carboxylic acid, octahydro-7-(hydroxymethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 7-(hydroxymethyl)octahydro-2H-pyrido[1,2-a]pyrazine-2-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-7-(hydroxymethyl)octahydro-2H-pyrido[1,2-a]pyrazin-2-carboxylat [German] [ACD/IUPAC Name]
7-(Hydroxyméthyl)octahydro-2H-pyrido[1,2-a]pyrazine-2-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
(7S,9AR)-TERT-BUTYL 7-(HYDROXYMETHYL)HEXAHYDRO-1H-PYRIDO[1,2-A]PYRAZINE-2(6H)-CARBOXYLATE
156772-96-2 [RN]
1824460-58-3 [RN]
207226-63-9 [RN]
2-Boc-7-hydroxymethyl-octahydro-pyrido[1,2-a]pyrazine
2H-Pyrido[1,2-a]pyrazine-2-carboxylic acid, octahydro-7-(hydroxymethyl)-, 1,1-dimethylethyl ester, (7R,9aS)-rel-
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 361.6±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 70.3±6.0 kJ/mol
    Flash Point: 172.5±25.1 °C
    Index of Refraction: 1.535
    Molar Refractivity: 73.9±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.92
    ACD/LogD (pH 5.5): -0.31
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.41
    ACD/LogD (pH 7.4): 1.23
    ACD/BCF (pH 7.4): 4.39
    ACD/KOC (pH 7.4): 84.40
    Polar Surface Area: 53 Å2
    Polarizability: 29.3±0.5 10-24cm3
    Surface Tension: 46.2±5.0 dyne/cm
    Molar Volume: 237.4±5.0 cm3

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