ChemSpider 2D Image | 3',6-Dimethoxy-5-nitro-3-biphenylcarboxylic acid | C15H13NO6

3',6-Dimethoxy-5-nitro-3-biphenylcarboxylic acid

  • Molecular FormulaC15H13NO6
  • Average mass303.267 Da
  • Monoisotopic mass303.074280 Da
  • ChemSpider ID28535952

More details:

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

[1,1'-Biphenyl]-3-carboxylic acid, 3',6-dimethoxy-5-nitro- [ACD/Index Name]
1381944-20-2 [RN]
3',6-Dimethoxy-5-nitro-3-biphenylcarbonsäure [German] [ACD/IUPAC Name]
3',6-Dimethoxy-5-nitro-3-biphenylcarboxylic acid [ACD/IUPAC Name]
Acide 3',6-diméthoxy-5-nitro-3-biphénylcarboxylique [French] [ACD/IUPAC Name]
[1381944-20-2] [RN]
3',6-Dimethoxy-5-nitro[1,1'-biphenyl]-3-carboxylic acid
3',6-Dimethoxy-5-nitro-[1,1'-biphenyl]-3-carboxylic acid
4-METHOXY-3-(3-METHOXYPHENYL)-5-NITROBENZOIC ACID
4-Methoxy-3-(3-methoxyphenyl)-5-nitrobenzoicacid
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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: 466.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 76.7±3.0 kJ/mol
    Flash Point: 235.9±28.7 °C
    Index of Refraction: 1.600
    Molar Refractivity: 77.7±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.01
    ACD/LogD (pH 5.5): 1.43
    ACD/BCF (pH 5.5): 2.76
    ACD/KOC (pH 5.5): 23.12
    ACD/LogD (pH 7.4): 0.13
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.17
    Polar Surface Area: 102 Å2
    Polarizability: 30.8±0.5 10-24cm3
    Surface Tension: 52.6±3.0 dyne/cm
    Molar Volume: 227.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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