Found 2 results

Search term: LKCMREMLEOKTFK (Found by InChIKey (skeleton match))
ChemSpider 2D Image | MFCD00024560 | C13H9IN2O2

MFCD00024560

  • Molecular FormulaC13H9IN2O2
  • Average mass352.127 Da
  • Monoisotopic mass351.970856 Da
  • ChemSpider ID21506444

More details:

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

3495-26-9 [RN]
4-iodo-N-(3-nitrobenzylidene)aniline
Benzenamine, 4-iodo-N-[(3-nitrophenyl)methylene]- [ACD/Index Name]
MFCD00024560
N-(4-Iodophenyl)-1-(3-nitrophenyl)methanimine [ACD/IUPAC Name]
N-(4-Iodophényl)-1-(3-nitrophényl)méthanimine [French] [ACD/IUPAC Name]
N-(4-Iodphenyl)-1-(3-nitrophenyl)methanimin [German] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 446.0±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.7±3.0 kJ/mol
Flash Point: 223.6±24.6 °C
Index of Refraction: 1.663
Molar Refractivity: 78.7±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.08
ACD/LogD (pH 5.5): 3.84
ACD/BCF (pH 5.5): 491.46
ACD/KOC (pH 5.5): 2938.42
ACD/LogD (pH 7.4): 3.84
ACD/BCF (pH 7.4): 491.67
ACD/KOC (pH 7.4): 2939.71
Polar Surface Area: 58 Å2
Polarizability: 31.2±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 212.6±7.0 cm3

Click to predict properties on the Chemicalize site


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