ChemSpider 2D Image | N-[1-(2,4-Dimethyl-1,3-thiazol-5-yl)ethyl]-3-iodoaniline | C13H15IN2S

N-[1-(2,4-Dimethyl-1,3-thiazol-5-yl)ethyl]-3-iodoaniline

  • Molecular FormulaC13H15IN2S
  • Average mass358.241 Da
  • Monoisotopic mass358.000061 Da
  • ChemSpider ID43529206

More details:

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

5-Thiazolemethanamine, N-(3-iodophenyl)-α,2,4-trimethyl- [ACD/Index Name]
N-[1-(2,4-Dimethyl-1,3-thiazol-5-yl)ethyl]-3-iodanilin [German] [ACD/IUPAC Name]
N-[1-(2,4-Dimethyl-1,3-thiazol-5-yl)ethyl]-3-iodoaniline [ACD/IUPAC Name]
N-[1-(2,4-Diméthyl-1,3-thiazol-5-yl)éthyl]-3-iodoaniline [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 428.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.4±3.0 kJ/mol
Flash Point: 213.0±27.3 °C
Index of Refraction: 1.673
Molar Refractivity: 84.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.29
ACD/LogD (pH 5.5): 4.07
ACD/BCF (pH 5.5): 716.47
ACD/KOC (pH 5.5): 3807.67
ACD/LogD (pH 7.4): 4.08
ACD/BCF (pH 7.4): 743.86
ACD/KOC (pH 7.4): 3953.25
Polar Surface Area: 53 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 53.0±3.0 dyne/cm
Molar Volume: 224.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement