ChemSpider 2D Image | Methyl 3-formyl-2-nitrobenzoate | C9H7NO5

Methyl 3-formyl-2-nitrobenzoate

  • Molecular FormulaC9H7NO5
  • Average mass209.156 Da
  • Monoisotopic mass209.032425 Da
  • ChemSpider ID23501026

More details:

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

138229-59-1 [RN]
3-Formyl-2-nitrobenzoate de méthyle [French] [ACD/IUPAC Name]
3-Formyl-2-nitrobenzoic acid methyl ester
Benzoic acid, 3-formyl-2-nitro-, methyl ester [ACD/Index Name]
Methyl 3-formyl-2-nitrobenzoate [ACD/IUPAC Name]
Methyl-3-formyl-2-nitrobenzoat [German] [ACD/IUPAC Name]
[138229-59-1] [RN]
3-Formyl-2-nitro-benzoic acid methyl ester
AK-59657
Benzyl methacrylate [ACD/IUPAC Name]
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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: 1.4±0.1 g/cm3
    Boiling Point: 353.7±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.9±3.0 kJ/mol
    Flash Point: 173.1±27.1 °C
    Index of Refraction: 1.596
    Molar Refractivity: 51.3±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.73
    ACD/LogD (pH 5.5): 1.72
    ACD/BCF (pH 5.5): 11.99
    ACD/KOC (pH 5.5): 206.03
    ACD/LogD (pH 7.4): 1.72
    ACD/BCF (pH 7.4): 11.99
    ACD/KOC (pH 7.4): 206.03
    Polar Surface Area: 89 Å2
    Polarizability: 20.3±0.5 10-24cm3
    Surface Tension: 56.0±3.0 dyne/cm
    Molar Volume: 150.8±3.0 cm3

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