ChemSpider 2D Image | 4-Iodo-1,2-benzothiazole | C7H4INS

4-Iodo-1,2-benzothiazole

  • Molecular FormulaC7H4INS
  • Average mass261.083 Da
  • Monoisotopic mass260.910919 Da
  • ChemSpider ID58185962

More details:

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

1,2-Benzisothiazole, 4-iodo- [ACD/Index Name]
4-Iod-1,2-benzothiazol [German] [ACD/IUPAC Name]
4-Iodo-1,2-benzothiazole [ACD/IUPAC Name]
4-Iodo-1,2-benzothiazole [French] [ACD/IUPAC Name]
139036-99-0 [RN]
2089309-94-2 [RN]
4-Iodobenzo[d]isothiazole
7-Iodobenzo[d]isothiazole
missing

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

Density: 2.0±0.1 g/cm3
Boiling Point: 239.1±22.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 45.7±3.0 kJ/mol
Flash Point: 98.4±22.3 °C
Index of Refraction: 1.773
Molar Refractivity: 53.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.55
ACD/LogD (pH 5.5): 3.18
ACD/BCF (pH 5.5): 152.18
ACD/KOC (pH 5.5): 1264.53
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 154.40
ACD/KOC (pH 7.4): 1283.00
Polar Surface Area: 41 Å2
Polarizability: 21.2±0.5 10-24cm3
Surface Tension: 64.8±3.0 dyne/cm
Molar Volume: 128.3±3.0 cm3

Click to predict properties on the Chemicalize site


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