ChemSpider 2D Image | 1-Iodo-2-isothiocyanatocyclohexane | C7H10INS

1-Iodo-2-isothiocyanatocyclohexane

  • Molecular FormulaC7H10INS
  • Average mass267.130 Da
  • Monoisotopic mass266.957855 Da
  • ChemSpider ID35771192

More details:

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

1-Iod-2-isothiocyanatocyclohexan [German] [ACD/IUPAC Name]
1-Iodo-2-isothiocyanatocyclohexane [ACD/IUPAC Name]
1-Iodo-2-isothiocyanatocyclohexane [French] [ACD/IUPAC Name]
Cyclohexane, 1-iodo-2-isothiocyanato- [ACD/Index Name]
CYCLOHEXANE, 1-IODO-2-ISOTHIOCYANATO-, TRANS-

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

Density: 1.8±0.1 g/cm3
Boiling Point: 313.9±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.3±3.0 kJ/mol
Flash Point: 143.7±24.8 °C
Index of Refraction: 1.673
Molar Refractivity: 55.3±0.5 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.50
ACD/LogD (pH 5.5): 3.57
ACD/BCF (pH 5.5): 301.50
ACD/KOC (pH 5.5): 2071.47
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 301.50
ACD/KOC (pH 7.4): 2071.47
Polar Surface Area: 44 Å2
Polarizability: 21.9±0.5 10-24cm3
Surface Tension: 44.5±7.0 dyne/cm
Molar Volume: 147.5±7.0 cm3

Click to predict properties on the Chemicalize site


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