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Search term: MF = 'C_{8}H_{7}F_{2}NO_{2}'
ChemSpider 2D Image | Methyl 2-amino-3,6-difluorobenzoate | C8H7F2NO2

Methyl 2-amino-3,6-difluorobenzoate

  • Molecular FormulaC8H7F2NO2
  • Average mass187.143 Da
  • Monoisotopic mass187.044479 Da
  • ChemSpider ID24748501

More details:

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

1184204-30-5 [RN]
2-Amino-3,6-difluorobenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-amino-3,6-difluoro-, methyl ester [ACD/Index Name]
Methyl 2-amino-3,6-difluorobenzoate [ACD/IUPAC Name]
Methyl-2-amino-3,6-difluorbenzoat [German] [ACD/IUPAC Name]
MFCD12159870 [MDL number]
[1184204-30-5] [RN]
95%
methyl-2-amino-3,6-difluorobenzoate
Methyl2-Amino-3,6-Difluorobenzoate

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: 263.7±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 50.2±3.0 kJ/mol
    Flash Point: 113.3±27.3 °C
    Index of Refraction: 1.524
    Molar Refractivity: 42.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.79
    ACD/LogD (pH 5.5): 2.46
    ACD/BCF (pH 5.5): 43.88
    ACD/KOC (pH 5.5): 521.41
    ACD/LogD (pH 7.4): 2.46
    ACD/BCF (pH 7.4): 43.88
    ACD/KOC (pH 7.4): 521.41
    Polar Surface Area: 52 Å2
    Polarizability: 16.7±0.5 10-24cm3
    Surface Tension: 42.4±3.0 dyne/cm
    Molar Volume: 138.0±3.0 cm3

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