ChemSpider 2D Image | 1-[2-(3,4-Diethoxyphenyl)ethyl]-3-(4-iodo-2-methylphenyl)thiourea | C20H25IN2O2S

1-[2-(3,4-Diethoxyphenyl)ethyl]-3-(4-iodo-2-methylphenyl)thiourea

  • Molecular FormulaC20H25IN2O2S
  • Average mass484.394 Da
  • Monoisotopic mass484.068146 Da
  • ChemSpider ID60474252

More details:

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

1-[2-(3,4-Diethoxyphenyl)ethyl]-3-(4-iod-2-methylphenyl)thioharnstoff [German] [ACD/IUPAC Name]
1-[2-(3,4-Diethoxyphenyl)ethyl]-3-(4-iodo-2-methylphenyl)thiourea [ACD/IUPAC Name]
1-[2-(3,4-Diéthoxyphényl)éthyl]-3-(4-iodo-2-méthylphényl)thiourée [French] [ACD/IUPAC Name]
Thiourea, N-[2-(3,4-diethoxyphenyl)ethyl]-N'-(4-iodo-2-methylphenyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 528.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.4±3.0 kJ/mol
Flash Point: 273.6±32.9 °C
Index of Refraction: 1.639
Molar Refractivity: 120.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 5.77
ACD/LogD (pH 5.5): 5.21
ACD/BCF (pH 5.5): 5325.72
ACD/KOC (pH 5.5): 16178.32
ACD/LogD (pH 7.4): 5.21
ACD/BCF (pH 7.4): 5325.54
ACD/KOC (pH 7.4): 16177.77
Polar Surface Area: 75 Å2
Polarizability: 47.9±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 335.8±3.0 cm3

Click to predict properties on the Chemicalize site


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