ChemSpider 2D Image | 7-Methyl-1,4-diazepan-5-one | C6H12N2O

7-Methyl-1,4-diazepan-5-one

  • Molecular FormulaC6H12N2O
  • Average mass128.172 Da
  • Monoisotopic mass128.094955 Da
  • ChemSpider ID24217632

More details:

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

5H-1,4-Diazepin-5-one, hexahydro-7-methyl- [ACD/Index Name]
7-Methyl-1,4-diazepan-5-on [German] [ACD/IUPAC Name]
7-Methyl-1,4-diazepan-5-one [ACD/IUPAC Name]
7-Méthyl-1,4-diazépan-5-one [French] [ACD/IUPAC Name]
90673-37-3 [RN]
Hexahydro-7-methyl-5H-1,4-Diazepin-5-one
(R)-7-Methyl-1,4-diazepan-5-one
[90673-37-3] [RN]
5H-1,4-Diazepin-5-one, hexahydro-7-methyl- (7CI)
7-methyl-[1,4]diazepan-5-one
More...

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 299.6±33.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.0±3.0 kJ/mol
    Flash Point: 146.7±25.5 °C
    Index of Refraction: 1.434
    Molar Refractivity: 34.6±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: -1.34
    ACD/LogD (pH 5.5): -3.44
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.73
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.30
    Polar Surface Area: 41 Å2
    Polarizability: 13.7±0.5 10-24cm3
    Surface Tension: 26.2±3.0 dyne/cm
    Molar Volume: 132.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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