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Search term: MF = 'C_{14}H_{19}IN_{2}O'
ChemSpider 2D Image | 3-[Ethyl(2-hydroxy-3-iodo-6-methylbenzyl)amino]-2-methylpropanenitrile | C14H19IN2O

3-[Ethyl(2-hydroxy-3-iodo-6-methylbenzyl)amino]-2-methylpropanenitrile

  • Molecular FormulaC14H19IN2O
  • Average mass358.218 Da
  • Monoisotopic mass358.054199 Da
  • ChemSpider ID30416274

More details:

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

3-[Ethyl(2-hydroxy-3-iod-6-methylbenzyl)amino]-2-methylpropannitril [German] [ACD/IUPAC Name]
3-[Ethyl(2-hydroxy-3-iodo-6-methylbenzyl)amino]-2-methylpropanenitrile [ACD/IUPAC Name]
3-[Éthyl(2-hydroxy-3-iodo-6-méthylbenzyl)amino]-2-méthylpropanenitrile [French] [ACD/IUPAC Name]
Propanenitrile, 3-[ethyl[(2-hydroxy-3-iodo-6-methylphenyl)methyl]amino]-2-methyl- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 405.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.2±3.0 kJ/mol
Flash Point: 198.7±28.7 °C
Index of Refraction: 1.593
Molar Refractivity: 82.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.38
ACD/LogD (pH 5.5): 1.68
ACD/BCF (pH 5.5): 5.60
ACD/KOC (pH 5.5): 52.38
ACD/LogD (pH 7.4): 2.80
ACD/BCF (pH 7.4): 72.11
ACD/KOC (pH 7.4): 674.33
Polar Surface Area: 47 Å2
Polarizability: 32.6±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 242.6±3.0 cm3

Click to predict properties on the Chemicalize site


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