ChemSpider 2D Image | (3-Fluoro-4-iodophenyl)acetic acid | C8H6FIO2

(3-Fluoro-4-iodophenyl)acetic acid

  • Molecular FormulaC8H6FIO2
  • Average mass280.035 Da
  • Monoisotopic mass279.939636 Da
  • ChemSpider ID28295580

More details:

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

(3-Fluor-4-iodphenyl)essigsäure [German] [ACD/IUPAC Name]
(3-Fluoro-4-iodophenyl)acetic acid [ACD/IUPAC Name]
Acide (3-fluoro-4-iodophényl)acétique [French] [ACD/IUPAC Name]
Benzeneacetic acid, 3-fluoro-4-iodo- [ACD/Index Name]
[1261874-58-1] [RN]
1261874-58-1 [RN]
2-(3-Fluoro-4-iodophenyl)acetic acid
2-(3-Fluoro-4-iodophenyl)aceticacid
3-fluoro-4-iodophenylacetic acid
MFCD18396995 [MDL number]

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: 2.0±0.1 g/cm3
    Boiling Point: 319.6±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 59.3±3.0 kJ/mol
    Flash Point: 147.1±23.7 °C
    Index of Refraction: 1.620
    Molar Refractivity: 50.3±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.50
    ACD/LogD (pH 5.5): 1.10
    ACD/BCF (pH 5.5): 1.76
    ACD/KOC (pH 5.5): 19.33
    ACD/LogD (pH 7.4): -0.62
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 37 Å2
    Polarizability: 19.9±0.5 10-24cm3
    Surface Tension: 54.2±3.0 dyne/cm
    Molar Volume: 143.2±3.0 cm3

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