ChemSpider 2D Image | Methyl 4'-nitro-3-biphenylcarboxylate | C14H11NO4

Methyl 4'-nitro-3-biphenylcarboxylate

  • Molecular FormulaC14H11NO4
  • Average mass257.241 Da
  • Monoisotopic mass257.068817 Da
  • ChemSpider ID28419985

More details:

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

[1,1'-Biphenyl]-3-carboxylic acid, 4'-nitro-, methyl ester [ACD/Index Name]
107558-26-9 [RN]
4'-Nitro-3-biphénylcarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 4'-nitro-[1,1'-biphenyl]-3-carboxylate
Methyl 4'-nitro-3-biphenylcarboxylate [ACD/IUPAC Name]
Methyl-4'-nitro-3-biphenylcarboxylat [German] [ACD/IUPAC Name]
[107558-26-9] [RN]
LD-0145
METHYL 3-(4-NITROPHENYL)BENZOATE
Methyl 4'-nitro[1,1'-biphenyl]-3-carboxylate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 421.1±28.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.5±3.0 kJ/mol
    Flash Point: 189.0±26.0 °C
    Index of Refraction: 1.592
    Molar Refractivity: 69.2±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.57
    ACD/LogD (pH 5.5): 3.74
    ACD/BCF (pH 5.5): 411.49
    ACD/KOC (pH 5.5): 2587.97
    ACD/LogD (pH 7.4): 3.74
    ACD/BCF (pH 7.4): 411.49
    ACD/KOC (pH 7.4): 2587.97
    Polar Surface Area: 72 Å2
    Polarizability: 27.4±0.5 10-24cm3
    Surface Tension: 49.0±3.0 dyne/cm
    Molar Volume: 204.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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