ChemSpider 2D Image | (3S)-3-Methyl-1,2,4-trithiolane | C3H6S3

(3S)-3-Methyl-1,2,4-trithiolane

  • Molecular FormulaC3H6S3
  • Average mass138.275 Da
  • Monoisotopic mass137.963165 Da
  • ChemSpider ID34991716

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Methyl-1,2,4-trithiolan [German] [ACD/IUPAC Name]
(3S)-3-Methyl-1,2,4-trithiolane [ACD/IUPAC Name]
(3S)-3-Méthyl-1,2,4-trithiolane [French] [ACD/IUPAC Name]
1,2,4-Trithiolane, 3-methyl-, (3S)- [ACD/Index Name]
3-Methyl-1,2,4-trithiolane [ACD/IUPAC Name]
51647-38-2 [RN]
UNII-JSM343XRB6

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

Density: 1.3±0.1 g/cm3
Boiling Point: 224.9±29.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.3±3.0 kJ/mol
Flash Point: 99.9±21.3 °C
Index of Refraction: 1.636
Molar Refractivity: 38.4±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.82
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 25.12
ACD/KOC (pH 5.5): 349.78
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 25.12
ACD/KOC (pH 7.4): 349.78
Polar Surface Area: 76 Å2
Polarizability: 15.2±0.5 10-24cm3
Surface Tension: 50.8±3.0 dyne/cm
Molar Volume: 107.1±3.0 cm3

Click to predict properties on the Chemicalize site


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