ChemSpider 2D Image | 3-Chloro-5-formylbenzonitrile | C8H4ClNO

3-Chloro-5-formylbenzonitrile

  • Molecular FormulaC8H4ClNO
  • Average mass165.577 Da
  • Monoisotopic mass164.998138 Da
  • ChemSpider ID29278626

More details:

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

3-Chlor-5-formylbenzonitril [German] [ACD/IUPAC Name]
3-Chloro-5-formylbenzonitrile [ACD/IUPAC Name]
3-Chloro-5-formylbenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 3-chloro-5-formyl- [ACD/Index Name]
1205513-88-7 [RN]
3-chloro-5-cyanobenzaldehyde
3-CHLORO-5-FORMYLBENZONITRILE|3-CHLORO-5-FORMYLBENZONITRILE
3-Cyano-5-chlorobenzaldehyde
95%
MFCD18392412

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 225.5±20.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 46.2±3.0 kJ/mol
    Flash Point: 90.2±21.8 °C
    Index of Refraction: 1.573
    Molar Refractivity: 41.1±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.89
    ACD/LogD (pH 5.5): 1.97
    ACD/BCF (pH 5.5): 18.34
    ACD/KOC (pH 5.5): 279.21
    ACD/LogD (pH 7.4): 1.97
    ACD/BCF (pH 7.4): 18.34
    ACD/KOC (pH 7.4): 279.21
    Polar Surface Area: 41 Å2
    Polarizability: 16.3±0.5 10-24cm3
    Surface Tension: 53.5±5.0 dyne/cm
    Molar Volume: 124.7±5.0 cm3

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