ChemSpider 2D Image | 1,3-Bis(2-ethylhexyl)-5,5-dimethylhexahydropyrimidine | C22H46N2

1,3-Bis(2-ethylhexyl)-5,5-dimethylhexahydropyrimidine

  • Molecular FormulaC22H46N2
  • Average mass338.614 Da
  • Monoisotopic mass338.366089 Da
  • ChemSpider ID32697287

More details:

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

1,3-Bis(2-ethylhexyl)-5,5-dimethylhexahydropyrimidin [German] [ACD/IUPAC Name]
1,3-Bis(2-ethylhexyl)-5,5-dimethylhexahydropyrimidine [ACD/IUPAC Name]
1,3-Bis(2-éthylhexyl)-5,5-diméthylhexahydropyrimidine [French] [ACD/IUPAC Name]
141-94-6 [RN]
Pyrimidine, 1,3-bis(2-ethylhexyl)hexahydro-5,5-dimethyl- [ACD/Index Name]
205-513-5 [EINECS]
5-Amino-1,3-bis(2-ethylhexyl)hexahydro-5-methylpyrimidine
MFCD00010428 [MDL number]

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: 0.8±0.1 g/cm3
    Boiling Point: 365.0±10.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.1±3.0 kJ/mol
    Flash Point: 151.8±6.8 °C
    Index of Refraction: 1.456
    Molar Refractivity: 109.1±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 12
    #Rule of 5 Violations: 1
    ACD/LogP: 8.34
    ACD/LogD (pH 5.5): 5.20
    ACD/BCF (pH 5.5): 1650.24
    ACD/KOC (pH 5.5): 1751.88
    ACD/LogD (pH 7.4): 6.87
    ACD/BCF (pH 7.4): 76522.73
    ACD/KOC (pH 7.4): 81235.47
    Polar Surface Area: 6 Å2
    Polarizability: 43.2±0.5 10-24cm3
    Surface Tension: 28.5±3.0 dyne/cm
    Molar Volume: 401.0±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement