ChemSpider 2D Image | Bis(ethylsulfanyl)acetic acid | C6H12O2S2

Bis(ethylsulfanyl)acetic acid

  • Molecular FormulaC6H12O2S2
  • Average mass180.288 Da
  • Monoisotopic mass180.028000 Da
  • ChemSpider ID25900580

More details:






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

Acetic acid, 2,2-bis(ethylthio)- [ACD/Index Name]
Acide bis(éthylsulfanyl)acétique [French] [ACD/IUPAC Name]
Bis(ethylsulfanyl)acetic acid [ACD/IUPAC Name]
Bis(ethylsulfanyl)essigsäure [German] [ACD/IUPAC Name]
10490-06-9 [RN]
2,2-bis(ethylsulfanyl)acetic acid
Acetic acid, bis(ethylthio)-
GLYOXYLIC ACID DIETHYL DITHIOACETAL
MFCD16876653

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

Density: 1.2±0.0 g/cm3
Boiling Point: 278.7±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 56.9±0.0 kJ/mol
Flash Point: 122.4±0.0 °C
Index of Refraction: 1.542
Molar Refractivity: 47.4±0.0 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.00
ACD/LogD (pH 5.5): 0.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.19
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 88 Å2
Polarizability: 18.8±0.0 10-24cm3
Surface Tension: 45.7±0.0 dyne/cm
Molar Volume: 150.5±0.0 cm3

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