ChemSpider 2D Image | anverene E | C10H13BrCl2O

anverene E

  • Molecular FormulaC10H13BrCl2O
  • Average mass300.020 Da
  • Monoisotopic mass297.952667 Da
  • ChemSpider ID72391405

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2R,4S,5R)-2-[(3E)-4-Brom-1,3-butadien-2-yl]-4,5-dichlor-5-methyltetrahydro-2H-pyran [German] [ACD/IUPAC Name]
(2R,4S,5R)-2-[(3E)-4-Bromo-1,3-butadien-2-yl]-4,5-dichloro-5-methyltetrahydro-2H-pyran [ACD/IUPAC Name]
(2R,4S,5R)-2-[(3E)-4-Bromo-1,3-butadién-2-yl]-4,5-dichloro-5-méthyltétrahydro-2H-pyrane [French] [ACD/IUPAC Name]
2H-Pyran, 2-[(2E)-3-bromo-1-methylene-2-propen-1-yl]-4,5-dichlorotetrahydro-5-methyl-, (2R,4S,5R)- [ACD/Index Name]
anverene E

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

Density: 1.4±0.1 g/cm3
Boiling Point: 360.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.2±3.0 kJ/mol
Flash Point: 171.9±27.9 °C
Index of Refraction: 1.535
Molar Refractivity: 64.9±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.48
ACD/LogD (pH 5.5): 3.60
ACD/BCF (pH 5.5): 318.15
ACD/KOC (pH 5.5): 2152.75
ACD/LogD (pH 7.4): 3.60
ACD/BCF (pH 7.4): 318.15
ACD/KOC (pH 7.4): 2152.75
Polar Surface Area: 9 Å2
Polarizability: 25.7±0.5 10-24cm3
Surface Tension: 38.1±5.0 dyne/cm
Molar Volume: 208.2±5.0 cm3

Click to predict properties on the Chemicalize site


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