ChemSpider 2D Image | 3-Dioxiranylmethanethiol | C2H4O2S

3-Dioxiranylmethanethiol

  • Molecular FormulaC2H4O2S
  • Average mass92.117 Da
  • Monoisotopic mass91.993202 Da
  • ChemSpider ID61709686

More details:

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

3-Dioxiranemethanethiol [ACD/Index Name]
3-Dioxiranylmethanethiol [ACD/IUPAC Name]
3-Dioxiranylméthanethiol [French] [ACD/IUPAC Name]
3-Dioxiranylmethanthiol [German] [ACD/IUPAC Name]
β-mercaptoethanol

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

BME [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 75.4±32.0 °C at 760 mmHg
Vapour Pressure: 115.4±0.1 mmHg at 25°C
Enthalpy of Vaporization: 30.3±3.0 kJ/mol
Flash Point: -0.6±25.1 °C
Index of Refraction: 1.491
Molar Refractivity: 20.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.55
ACD/LogD (pH 5.5): 0.62
ACD/BCF (pH 5.5): 1.75
ACD/KOC (pH 5.5): 51.96
ACD/LogD (pH 7.4): 0.62
ACD/BCF (pH 7.4): 1.74
ACD/KOC (pH 7.4): 51.76
Polar Surface Area: 64 Å2
Polarizability: 8.1±0.5 10-24cm3
Surface Tension: 48.1±3.0 dyne/cm
Molar Volume: 70.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement