Found 80 results

Search term: MF = 'C_{8}H_{6}INS'
ChemSpider 2D Image | 1-(Iodomethyl)-2-isothiocyanatobenzene | C8H6INS

1-(Iodomethyl)-2-isothiocyanatobenzene

  • Molecular FormulaC8H6INS
  • Average mass275.109 Da
  • Monoisotopic mass274.926544 Da
  • ChemSpider ID61143232

More details:

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

1-(Iodmethyl)-2-isothiocyanatobenzol [German] [ACD/IUPAC Name]
1-(Iodomethyl)-2-isothiocyanatobenzene [ACD/IUPAC Name]
1-(Iodométhyl)-2-isothiocyanatobenzène [French] [ACD/IUPAC Name]
Benzene, 1-(iodomethyl)-2-isothiocyanato- [ACD/Index Name]
108288-42-2 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 340.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.1±3.0 kJ/mol
Flash Point: 159.8±25.9 °C
Index of Refraction: 1.653
Molar Refractivity: 59.9±0.5 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.18
ACD/LogD (pH 5.5): 4.01
ACD/BCF (pH 5.5): 662.93
ACD/KOC (pH 5.5): 3640.88
ACD/LogD (pH 7.4): 4.01
ACD/BCF (pH 7.4): 662.93
ACD/KOC (pH 7.4): 3640.88
Polar Surface Area: 44 Å2
Polarizability: 23.7±0.5 10-24cm3
Surface Tension: 43.2±7.0 dyne/cm
Molar Volume: 163.7±7.0 cm3

Click to predict properties on the Chemicalize site


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