ChemSpider 2D Image | 4-Iodo-2-methylbenzenecarbothioic O-acid | C8H7IOS

4-Iodo-2-methylbenzenecarbothioic O-acid

  • Molecular FormulaC8H7IOS
  • Average mass278.110 Da
  • Monoisotopic mass277.926208 Da
  • ChemSpider ID60838113

More details:






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

4-Iod-2-methylbenzolcarbothio-O-säure [German] [ACD/IUPAC Name]
4-Iodo-2-methylbenzenecarbothioic O-acid [ACD/IUPAC Name]
Benzenecarbothioic acid, 4-iodo-2-methyl- [ACD/Index Name]
O-Acide de 4-iodo-2-méthylbenzènecarbothioïque [French] [ACD/IUPAC Name]
1823028-43-8 [RN]
MFCD22489986

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.9±0.1 g/cm3
Boiling Point: 341.8±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.8±3.0 kJ/mol
Flash Point: 160.5±30.7 °C
Index of Refraction: 1.714
Molar Refractivity: 58.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.34
ACD/LogD (pH 5.5): 1.36
ACD/BCF (pH 5.5): 2.54
ACD/KOC (pH 5.5): 23.10
ACD/LogD (pH 7.4): 0.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.01
Polar Surface Area: 52 Å2
Polarizability: 23.1±0.5 10-24cm3
Surface Tension: 67.1±3.0 dyne/cm
Molar Volume: 148.2±3.0 cm3

Click to predict properties on the Chemicalize site






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