ChemSpider 2D Image | 1-(4-Iodophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine | C13H15IN2S

1-(4-Iodophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine

  • Molecular FormulaC13H15IN2S
  • Average mass358.241 Da
  • Monoisotopic mass358.000061 Da
  • ChemSpider ID68917434

More details:

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

1-(4-Iodophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine [ACD/IUPAC Name]
1-(4-Iodophényl)-N-[(2-méthyl-1,3-thiazol-4-yl)méthyl]éthanamine [French] [ACD/IUPAC Name]
1-(4-Iodphenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]ethanamin [German] [ACD/IUPAC Name]
4-Thiazolemethanamine, N-[1-(4-iodophenyl)ethyl]-2-methyl- [ACD/Index 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: 401.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.2±3.0 kJ/mol
Flash Point: 196.4±25.9 °C
Index of Refraction: 1.638
Molar Refractivity: 82.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.68
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 20.19
ACD/KOC (pH 5.5): 141.17
ACD/LogD (pH 7.4): 3.46
ACD/BCF (pH 7.4): 243.02
ACD/KOC (pH 7.4): 1699.49
Polar Surface Area: 53 Å2
Polarizability: 32.8±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 230.1±3.0 cm3

Click to predict properties on the Chemicalize site


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