Found 24 results

Search term: MF = 'C_{5}H_{8}O_{3}S_{2}'
ChemSpider 2D Image | 3-[(Methoxycarbonothioyl)sulfanyl]propanoic acid | C5H8O3S2

3-[(Methoxycarbonothioyl)sulfanyl]propanoic acid

  • Molecular FormulaC5H8O3S2
  • Average mass180.245 Da
  • Monoisotopic mass179.991486 Da
  • ChemSpider ID60745452

More details:

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

3-[(Methoxycarbonothioyl)sulfanyl]propanoic acid [ACD/IUPAC Name]
3-[(Methoxycarbonothioyl)sulfanyl]propansäure [German] [ACD/IUPAC Name]
Acide 3-[(méthoxycarbonothioyl)sulfanyl]propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[(methoxythioxomethyl)thio]- [ACD/Index Name]
89364-36-3 [RN]
MFCD01217382

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

Density: 1.4±0.1 g/cm3
Boiling Point: 326.6±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 62.5±6.0 kJ/mol
Flash Point: 151.3±23.2 °C
Index of Refraction: 1.583
Molar Refractivity: 43.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.34
ACD/LogD (pH 5.5): -0.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.62
ACD/LogD (pH 7.4): -2.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 104 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 63.4±3.0 dyne/cm
Molar Volume: 131.0±3.0 cm3

Click to predict properties on the Chemicalize site


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