ChemSpider 2D Image | (2R,4R)-4,8-Dimethyl-4-vinyl-1,2,8-nonanetriol | C13H26O3

(2R,4R)-4,8-Dimethyl-4-vinyl-1,2,8-nonanetriol

  • Molecular FormulaC13H26O3
  • Average mass230.344 Da
  • Monoisotopic mass230.188202 Da
  • ChemSpider ID23498927
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(2R,4R)-4,8-Dimethyl-4-vinyl-1,2,8-nonanetriol [ACD/IUPAC Name]
(2R,4R)-4,8-Diméthyl-4-vinyl-1,2,8-nonanetriol [French] [ACD/IUPAC Name]
(2R,4R)-4,8-Dimethyl-4-vinyl-1,2,8-nonantriol [German] [ACD/IUPAC Name]
(2R,4R)-4,8-Dimethyl-4-vinyl-nonane; -1,2,8-triol
(2R,4R)-4,8-Dimethyl-4-vinylnonane-1,2,8-triol
1,2,8-Nonanetriol, 4-ethenyl-4,8-dimethyl-, (2R,4R)- [ACD/Index Name]
(2R,4R)-4,8-Dimethyl-4-vinyl-nonane
(2R,4R)-4,8-DIMETHYL-4-VINYL-NONANE-1,2,8-TRIOL
-1,2,8-triol
130703-28-5 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 365.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 70.8±6.0 kJ/mol
Flash Point: 167.2±22.5 °C
Index of Refraction: 1.487
Molar Refractivity: 66.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.92
ACD/LogD (pH 5.5): 1.41
ACD/BCF (pH 5.5): 6.92
ACD/KOC (pH 5.5): 138.97
ACD/LogD (pH 7.4): 1.41
ACD/BCF (pH 7.4): 6.92
ACD/KOC (pH 7.4): 138.97
Polar Surface Area: 61 Å2
Polarizability: 26.4±0.5 10-24cm3
Surface Tension: 38.6±3.0 dyne/cm
Molar Volume: 231.2±3.0 cm3

Click to predict properties on the Chemicalize site






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