ChemSpider 2D Image | (3-Bromo-5-nitrophenyl)(1-piperidinyl)methanone | C12H13BrN2O3

(3-Bromo-5-nitrophenyl)(1-piperidinyl)methanone

  • Molecular FormulaC12H13BrN2O3
  • Average mass313.147 Da
  • Monoisotopic mass312.010956 Da
  • ChemSpider ID21472899

More details:

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

(3-Brom-5-nitrophenyl)(1-piperidinyl)methanon [German] [ACD/IUPAC Name]
(3-Bromo-5-nitrophenyl)(1-piperidinyl)methanone [ACD/IUPAC Name]
(3-Bromo-5-nitrophényl)(1-pipéridinyl)méthanone [French] [ACD/IUPAC Name]
(3-Bromo-5-nitrophenyl)(piperidin-1-yl)methanone
941294-21-9 [RN]
Methanone, (3-bromo-5-nitrophenyl)-1-piperidinyl- [ACD/Index Name]
(3-bromo-5-nitrophenyl)-piperidin-1-ylmethanone
[941294-21-9] [RN]
1-(3-Bromo-5-nitrobenzoyl)piperidine
'941294-21-9 [EINECS]
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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: 1.5±0.1 g/cm3
    Boiling Point: 447.1±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.5±3.0 kJ/mol
    Flash Point: 224.2±25.9 °C
    Index of Refraction: 1.613
    Molar Refractivity: 70.5±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.13
    ACD/LogD (pH 5.5): 2.61
    ACD/BCF (pH 5.5): 57.02
    ACD/KOC (pH 5.5): 628.87
    ACD/LogD (pH 7.4): 2.61
    ACD/BCF (pH 7.4): 57.02
    ACD/KOC (pH 7.4): 628.87
    Polar Surface Area: 66 Å2
    Polarizability: 28.0±0.5 10-24cm3
    Surface Tension: 56.0±3.0 dyne/cm
    Molar Volume: 202.6±3.0 cm3

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