ChemSpider 2D Image | (2R,2'S,3aR,6aS)-2',3a-Dimethylhexahydrospiro[1,3-dithiolo[4,5-b]furan-2,3'-furan] (non-preferred name) | C10H16O2S2

(2R,2'S,3aR,6aS)-2',3a-Dimethylhexahydrospiro[1,3-dithiolo[4,5-b]furan-2,3'-furan] (non-preferred name)

  • Molecular FormulaC10H16O2S2
  • Average mass232.363 Da
  • Monoisotopic mass232.059174 Da
  • ChemSpider ID34994198

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R,2'S,3aR,6aS)-2',3a-Dimethylhexahydrospiro[1,3-dithiolo[4,5-b]furan-2,3'-furan] (non-preferred name) [ACD/IUPAC Name]
253-884-7 [EINECS]
38325-25-6 [RN]
SPIRO(2,4-DITHIA-1-METHYL-8-OXABICYCLO(3.3.0)OCTANE-3,3'- (1'-OXA-2'-METHYL)CYCLOPENTANE)
UNII-TER5ZXE00D

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

Density: 1.3±0.1 g/cm3
Boiling Point: 356.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 57.8±3.0 kJ/mol
Flash Point: 169.5±27.9 °C
Index of Refraction: 1.600
Molar Refractivity: 61.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 1.62
ACD/BCF (pH 5.5): 10.00
ACD/KOC (pH 5.5): 180.94
ACD/LogD (pH 7.4): 1.62
ACD/BCF (pH 7.4): 10.00
ACD/KOC (pH 7.4): 180.94
Polar Surface Area: 69 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 48.5±5.0 dyne/cm
Molar Volume: 180.4±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement