ChemSpider 2D Image | 3-Ethoxy-4-iodobenzonitrile | C9H8INO

3-Ethoxy-4-iodobenzonitrile

  • Molecular FormulaC9H8INO
  • Average mass273.070 Da
  • Monoisotopic mass272.965057 Da
  • ChemSpider ID26540757

More details:

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

3-Ethoxy-4-iodbenzonitril [German] [ACD/IUPAC Name]
3-Ethoxy-4-iodobenzonitrile [ACD/IUPAC Name]
3-Éthoxy-4-iodobenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 3-ethoxy-4-iodo- [ACD/Index Name]
933585-40-1 [RN]
MFCD09753720

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

PubChem Substance ID 24859066 [DBID]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 316.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.8±3.0 kJ/mol
Flash Point: 145.4±26.5 °C
Index of Refraction: 1.613
Molar Refractivity: 55.2±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): 3.12
ACD/BCF (pH 5.5): 138.34
ACD/KOC (pH 5.5): 1186.04
ACD/LogD (pH 7.4): 3.12
ACD/BCF (pH 7.4): 138.34
ACD/KOC (pH 7.4): 1186.04
Polar Surface Area: 33 Å2
Polarizability: 21.9±0.5 10-24cm3
Surface Tension: 51.8±5.0 dyne/cm
Molar Volume: 158.7±5.0 cm3

Click to predict properties on the Chemicalize site


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