ChemSpider 2D Image | MFCD01862980 | C15H24

MFCD01862980

  • Molecular FormulaC15H24
  • Average mass204.351 Da
  • Monoisotopic mass204.187805 Da
  • ChemSpider ID21171333

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

(-)-β-chamigrene
(+)-β-chamigrene
(6S)-3,7,7-Trimethyl-11-methylenespiro[5.5]undec-2-ene [ACD/IUPAC Name]
(6S)-3,7,7-Triméthyl-11-méthylènespiro[5.5]undéc-2-ène [French] [ACD/IUPAC Name]
(6S)-3,7,7-Trimethyl-11-methylenspiro[5.5]undec-2-en [German] [ACD/IUPAC Name]
(R)-11-Methylene-3,7,7-trimethylspiro[5.5]undec-2-ene
18431-82-8 [RN]
MFCD01862980
Spiro[5.5]undec-2-ene, 3,7,7-trimethyl-11-methylene-, (6S)- [ACD/Index Name]
(−)-β-Chamigrene
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2553619 [DBID]
22480_FLUKA [DBID]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 273.2±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 49.1±0.8 kJ/mol
Flash Point: 107.3±16.6 °C
Index of Refraction: 1.497
Molar Refractivity: 66.6±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 6.75
ACD/LogD (pH 5.5): 6.15
ACD/BCF (pH 5.5): 27975.01
ACD/KOC (pH 5.5): 53037.45
ACD/LogD (pH 7.4): 6.15
ACD/BCF (pH 7.4): 27975.01
ACD/KOC (pH 7.4): 53037.45
Polar Surface Area: 0 Å2
Polarizability: 26.4±0.5 10-24cm3
Surface Tension: 30.2±5.0 dyne/cm
Molar Volume: 227.6±5.0 cm3

Click to predict properties on the Chemicalize site


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