ChemSpider 2D Image | [1,3-Butadiyne-1,4-diyldi(2S,3R)-3,2-oxiranediyl]dimethanol | C10H10O4

[1,3-Butadiyne-1,4-diyldi(2S,3R)-3,2-oxiranediyl]dimethanol

  • Molecular FormulaC10H10O4
  • Average mass194.184 Da
  • Monoisotopic mass194.057907 Da
  • ChemSpider ID33286853

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

[1,3-Butadiin-1,4-diyldi(2S,3R)-3,2-oxirandiyl]dimethanol [German] [ACD/IUPAC Name]
[1,3-Butadiyne-1,4-diyldi(2S,3R)-3,2-oxiranediyl]dimethanol [ACD/IUPAC Name]
[1,3-Butadiyne-1,4-diyldi(2S,3R)-3,2-oxiranediyl]diméthanol [French] [ACD/IUPAC Name]
L-manno-Deca-4,6-diynitol, 2,3:8,9-dianhydro-4,5,6,7-tetradeoxy- [ACD/Index Name]
147921-90-2 [RN]
Repandiol

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

Density: 1.5±0.1 g/cm3
Boiling Point: 448.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 81.6±6.0 kJ/mol
Flash Point: 225.0±28.7 °C
Index of Refraction: 1.619
Molar Refractivity: 46.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.05
ACD/LogD (pH 5.5): -0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.36
ACD/LogD (pH 7.4): -0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 19.36
Polar Surface Area: 66 Å2
Polarizability: 18.5±0.5 10-24cm3
Surface Tension: 75.5±5.0 dyne/cm
Molar Volume: 133.2±5.0 cm3

Click to predict properties on the Chemicalize site


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