Found 11 results

Search term: MF = 'C_{22}H_{21}BrO'
ChemSpider 2D Image | (6R)-7-Bromo-3,3-dimethyl-2,4-diphenyltricyclo[3.3.0.0~2,4~]oct-7-en-6-ol | C22H21BrO

(6R)-7-Bromo-3,3-dimethyl-2,4-diphenyltricyclo[3.3.0.02,4]oct-7-en-6-ol

  • Molecular FormulaC22H21BrO
  • Average mass381.306 Da
  • Monoisotopic mass380.077576 Da
  • ChemSpider ID22898305

  • defined stereocentres - 1 of 5 defined stereocentres

More details:

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

(6R)-7-Brom-3,3-dimethyl-2,4-diphenyltricyclo[3.3.0.02,4]oct-7-en-6-ol [German] [ACD/IUPAC Name]
(6R)-7-Bromo-3,3-dimethyl-2,4-diphenyltricyclo[3.3.0.02,4]oct-7-en-6-ol [ACD/IUPAC Name]
(6R)-7-Bromo-3,3-diméthyl-2,4-diphényltricyclo[3.3.0.02,4]oct-7-én-6-ol [French] [ACD/IUPAC Name]
Tricyclo[3.3.0.02,4]oct-7-en-6-ol, 7-bromo-3,3-dimethyl-2,4-diphenyl-, (6R)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 455.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 229.2±28.7 °C
Index of Refraction: 1.686
Molar Refractivity: 100.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.82
ACD/LogD (pH 5.5): 5.83
ACD/BCF (pH 5.5): 15753.63
ACD/KOC (pH 5.5): 35161.91
ACD/LogD (pH 7.4): 5.82
ACD/BCF (pH 7.4): 15753.59
ACD/KOC (pH 7.4): 35161.84
Polar Surface Area: 20 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 58.2±3.0 dyne/cm
Molar Volume: 262.9±3.0 cm3

Click to predict properties on the Chemicalize site


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