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Search term: MF = 'C_{12}H_{16}N_{2}O_{2}S'
ChemSpider 2D Image | 3-(Cyclohexylsulfanyl)-5-nitroaniline | C12H16N2O2S

3-(Cyclohexylsulfanyl)-5-nitroaniline

  • Molecular FormulaC12H16N2O2S
  • Average mass252.333 Da
  • Monoisotopic mass252.093246 Da
  • ChemSpider ID21800766

More details:

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

3-(Cyclohexylsulfanyl)-5-nitroanilin [German] [ACD/IUPAC Name]
3-(Cyclohexylsulfanyl)-5-nitroaniline [ACD/IUPAC Name]
3-(Cyclohexylsulfanyl)-5-nitroaniline [French] [ACD/IUPAC Name]
3-(Cyclohexylthio)-5-nitrobenzenamine
898808-59-8 [RN]
Benzenamine, 3-(cyclohexylthio)-5-nitro- [ACD/Index Name]
3-(Cyclohexylthio)-5-nitroaniline
3-cyclohexylsulfanyl-5-nitroaniline

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

MFCD03419518 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 428.7±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.4±3.0 kJ/mol
    Flash Point: 213.1±25.9 °C
    Index of Refraction: 1.620
    Molar Refractivity: 70.1±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.14
    ACD/LogD (pH 5.5): 3.74
    ACD/BCF (pH 5.5): 412.42
    ACD/KOC (pH 5.5): 2592.10
    ACD/LogD (pH 7.4): 3.74
    ACD/BCF (pH 7.4): 412.45
    ACD/KOC (pH 7.4): 2592.33
    Polar Surface Area: 97 Å2
    Polarizability: 27.8±0.5 10-24cm3
    Surface Tension: 57.7±5.0 dyne/cm
    Molar Volume: 199.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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