Found 1 result

Search term: 78438968 (Found by CSID)
ChemSpider 2D Image | (4aS,7S)-4a,7-Dimethyl-2-oxo-4a,5,6,7-tetrahydro-2H-benzo[7]annulene-8-carbaldehyde | C14H16O2

(4aS,7S)-4a,7-Dimethyl-2-oxo-4a,5,6,7-tetrahydro-2H-benzo[7]annulene-8-carbaldehyde

  • Molecular FormulaC14H16O2
  • Average mass216.276 Da
  • Monoisotopic mass216.115036 Da
  • ChemSpider ID78438968

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4aS,7S)-4a,7-Dimethyl-2-oxo-4a,5,6,7-tetrahydro-2H-benzo[7]annulen-8-carbaldehyd [German] [ACD/IUPAC Name]
(4aS,7S)-4a,7-Dimethyl-2-oxo-4a,5,6,7-tetrahydro-2H-benzo[7]annulene-8-carbaldehyde [ACD/IUPAC Name]
(4aS,7S)-4a,7-Diméthyl-2-oxo-4a,5,6,7-tétrahydro-2H-benzo[7]annulène-8-carbaldéhyde [French] [ACD/IUPAC Name]
2H-Benzocycloheptene-8-carboxaldehyde, 4a,5,6,7-tetrahydro-4a,7-dimethyl-2-oxo-, (4aS,7S)- [ACD/Index Name]
Ochracene D

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

Density: 1.1±0.1 g/cm3
Boiling Point: 373.4±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.1±3.0 kJ/mol
Flash Point: 140.1±21.8 °C
Index of Refraction: 1.547
Molar Refractivity: 62.5±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.87
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 16.63
ACD/KOC (pH 5.5): 260.30
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 16.63
ACD/KOC (pH 7.4): 260.30
Polar Surface Area: 34 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 39.9±5.0 dyne/cm
Molar Volume: 197.1±5.0 cm3

Click to predict properties on the Chemicalize site


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