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Search term: ROMNXBWMWNAFGI (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-Iodo-2-methyl-N-(3-phenyl-2-propyn-1-yl)aniline | C16H14IN

3-Iodo-2-methyl-N-(3-phenyl-2-propyn-1-yl)aniline

  • Molecular FormulaC16H14IN
  • Average mass347.194 Da
  • Monoisotopic mass347.017090 Da
  • ChemSpider ID68985183

More details:

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

3-Iod-2-methyl-N-(3-phenyl-2-propin-1-yl)anilin [German] [ACD/IUPAC Name]
3-Iodo-2-methyl-N-(3-phenyl-2-propyn-1-yl)aniline [ACD/IUPAC Name]
3-Iodo-2-méthyl-N-(3-phényl-2-propyn-1-yl)aniline [French] [ACD/IUPAC Name]
Benzenamine, 3-iodo-2-methyl-N-(3-phenyl-2-propyn-1-yl)- [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: 458.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.8±3.0 kJ/mol
Flash Point: 230.8±27.3 °C
Index of Refraction: 1.671
Molar Refractivity: 84.6±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.13
ACD/LogD (pH 5.5): 5.41
ACD/BCF (pH 5.5): 7639.81
ACD/KOC (pH 5.5): 20944.37
ACD/LogD (pH 7.4): 5.41
ACD/BCF (pH 7.4): 7641.88
ACD/KOC (pH 7.4): 20950.03
Polar Surface Area: 12 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 54.9±5.0 dyne/cm
Molar Volume: 226.0±5.0 cm3

Click to predict properties on the Chemicalize site


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