ChemSpider 2D Image | (R)-methyl 2-mercaptopropionate | C4H8O2S

(R)-methyl 2-mercaptopropionate

  • Molecular FormulaC4H8O2S
  • Average mass120.170 Da
  • Monoisotopic mass120.024498 Da
  • ChemSpider ID34990700

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-Sulfanylpropanoate de méthyle [French] [ACD/IUPAC Name]
(R)-methyl 2-mercaptopropionate
82031-68-3 [RN]
Methyl (2R)-2-sulfanylpropanoate [ACD/IUPAC Name]
Methyl-(2R)-2-sulfanylpropanoat [German] [ACD/IUPAC Name]
Propanoic acid, 2-mercapto-, methyl ester, (2R)- [ACD/Index Name]
258-856-8 [EINECS]
53907-46-3 [RN]
methyl 2-mercaptopropionate
METHYL 2-MERCAPTOPROPIONATE, (R)-
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

G5T7543ZOK [DBID]
UNII:G5T7543ZOK [DBID]
UNII-G5T7543ZOK [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 149.3±13.0 °C at 760 mmHg
Vapour Pressure: 4.1±0.3 mmHg at 25°C
Enthalpy of Vaporization: 38.6±3.0 kJ/mol
Flash Point: 40.0±7.8 °C
Index of Refraction: 1.450
Molar Refractivity: 30.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.00
ACD/LogD (pH 5.5): 1.16
ACD/BCF (pH 5.5): 4.49
ACD/KOC (pH 5.5): 101.91
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 4.15
ACD/KOC (pH 7.4): 94.17
Polar Surface Area: 65 Å2
Polarizability: 12.0±0.5 10-24cm3
Surface Tension: 30.9±3.0 dyne/cm
Molar Volume: 112.5±3.0 cm3

Click to predict properties on the Chemicalize site


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