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Search term: MF = 'C_{14}H_{13}NO_{2}S'
ChemSpider 2D Image | (2,4-diMethylphenyl)(2-nitrophenyl)sulfane | C14H13NO2S

(2,4-diMethylphenyl)(2-nitrophenyl)sulfane

  • Molecular FormulaC14H13NO2S
  • Average mass259.323 Da
  • Monoisotopic mass259.066711 Da
  • ChemSpider ID57573469

More details:

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

(2,4-diMethylphenyl)(2-nitrophenyl)sulfane
1610527-49-5 [RN]
2,4-Dimethyl-1-[(2-nitrophenyl)sulfanyl]benzene [ACD/IUPAC Name]
2,4-Diméthyl-1-[(2-nitrophényl)sulfanyl]benzène [French] [ACD/IUPAC Name]
2,4-Dimethyl-1-[(2-nitrophenyl)sulfanyl]benzol [German] [ACD/IUPAC Name]
Benzene, 2,4-dimethyl-1-[(2-nitrophenyl)thio]- [ACD/Index Name]
DS-19502
MFCD27918698

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 353.9±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 57.5±3.0 kJ/mol
    Flash Point: 167.8±24.6 °C
    Index of Refraction: 1.638
    Molar Refractivity: 74.8±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 1
    ACD/LogP: 5.30
    ACD/LogD (pH 5.5): 4.90
    ACD/BCF (pH 5.5): 3095.00
    ACD/KOC (pH 5.5): 10970.08
    ACD/LogD (pH 7.4): 4.90
    ACD/BCF (pH 7.4): 3095.00
    ACD/KOC (pH 7.4): 10970.08
    Polar Surface Area: 71 Å2
    Polarizability: 29.6±0.5 10-24cm3
    Surface Tension: 53.8±5.0 dyne/cm
    Molar Volume: 208.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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