ChemSpider 2D Image | S-Phenyl iodoethanethioate | C8H7IOS

S-Phenyl iodoethanethioate

  • Molecular FormulaC8H7IOS
  • Average mass278.110 Da
  • Monoisotopic mass277.926208 Da
  • ChemSpider ID35784134

More details:

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

Ethanethioic acid, 2-iodo-, S-phenyl ester [ACD/Index Name]
Iodoéthanethioate de S-phényle [French] [ACD/IUPAC Name]
S-Phenyl iodoethanethioate [ACD/IUPAC Name]
S-Phenyl-iodethanthioat [German] [ACD/IUPAC Name]
67532-83-6 [RN]
ETHANETHIOIC ACID, IODO-, S-PHENYL ESTER

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

Density: 1.8±0.1 g/cm3
Boiling Point: 307.4±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.8±3.0 kJ/mol
Flash Point: 139.7±23.2 °C
Index of Refraction: 1.662
Molar Refractivity: 57.1±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.28
ACD/LogD (pH 5.5): 2.86
ACD/BCF (pH 5.5): 88.22
ACD/KOC (pH 5.5): 859.48
ACD/LogD (pH 7.4): 2.86
ACD/BCF (pH 7.4): 88.22
ACD/KOC (pH 7.4): 859.48
Polar Surface Area: 42 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 53.5±5.0 dyne/cm
Molar Volume: 154.2±5.0 cm3

Click to predict properties on the Chemicalize site


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