Found 37 results

Search term: MF = 'C_{13}H_{9}IN_{2}S'
ChemSpider 2D Image | 2-(3-Iodophenyl)-1,3-benzothiazol-6-amine | C13H9IN2S

2-(3-Iodophenyl)-1,3-benzothiazol-6-amine

  • Molecular FormulaC13H9IN2S
  • Average mass352.193 Da
  • Monoisotopic mass351.953094 Da
  • ChemSpider ID71409882

More details:

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

2-(3-Iodophenyl)-1,3-benzothiazol-6-amine [ACD/IUPAC Name]
2-(3-Iodophényl)-1,3-benzothiazol-6-amine [French] [ACD/IUPAC Name]
2-(3-Iodphenyl)-1,3-benzothiazol-6-amin [German] [ACD/IUPAC Name]
6-Benzothiazolamine, 2-(3-iodophenyl)- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 502.1±56.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.1±3.0 kJ/mol
Flash Point: 257.5±31.8 °C
Index of Refraction: 1.782
Molar Refractivity: 82.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.21
ACD/LogD (pH 5.5): 3.76
ACD/BCF (pH 5.5): 421.61
ACD/KOC (pH 5.5): 2631.46
ACD/LogD (pH 7.4): 3.76
ACD/BCF (pH 7.4): 422.70
ACD/KOC (pH 7.4): 2638.24
Polar Surface Area: 67 Å2
Polarizability: 32.6±0.5 10-24cm3
Surface Tension: 68.3±3.0 dyne/cm
Molar Volume: 195.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement