ChemSpider 2D Image | (3R)-3-[(1E)-1-Octen-1-yl]dihydro-2,5-furandione | C12H18O3

(3R)-3-[(1E)-1-Octen-1-yl]dihydro-2,5-furandione

  • Molecular FormulaC12H18O3
  • Average mass210.270 Da
  • Monoisotopic mass210.125595 Da
  • ChemSpider ID34985572

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-[(1E)-1-Octen-1-yl]dihydro-2,5-furandion [German] [ACD/IUPAC Name]
(3R)-3-[(1E)-1-Octen-1-yl]dihydro-2,5-furandione [ACD/IUPAC Name]
(3R)-3-[(1E)-1-Octén-1-yl]dihydro-2,5-furanedione [French] [ACD/IUPAC Name]
2,5-Furandione, dihydro-3-[(1E)-1-octen-1-yl]-, (3R)- [ACD/Index Name]
231-828-2 [EINECS]
7757-96-2 [RN]
UNII-5S74LKR65F
UNII-U91L3410OL

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

Density: 1.1±0.1 g/cm3
Boiling Point: 328.2±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.1±3.0 kJ/mol
Flash Point: 147.1±22.0 °C
Index of Refraction: 1.532
Molar Refractivity: 59.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.65
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 37.05
ACD/KOC (pH 5.5): 461.88
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 37.05
ACD/KOC (pH 7.4): 461.88
Polar Surface Area: 43 Å2
Polarizability: 23.5±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 191.2±3.0 cm3

Click to predict properties on the Chemicalize site


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