Found 11 results

Search term: MF = 'C_{22}H_{21}BrO'
ChemSpider 2D Image | (2S)-2-(4-Bromophenyl)-2-methyl-3,3-diphenyl-1-propanol | C22H21BrO

(2S)-2-(4-Bromophenyl)-2-methyl-3,3-diphenyl-1-propanol

  • Molecular FormulaC22H21BrO
  • Average mass381.306 Da
  • Monoisotopic mass380.077576 Da
  • ChemSpider ID77428344

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-(4-Bromophenyl)-2-methyl-3,3-diphenyl-1-propanol [ACD/IUPAC Name]
(2S)-2-(4-Bromophényl)-2-méthyl-3,3-diphényl-1-propanol [French] [ACD/IUPAC Name]
(2S)-2-(4-Bromphenyl)-2-methyl-3,3-diphenyl-1-propanol [German] [ACD/IUPAC Name]
Benzenepropanol, β-(4-bromophenyl)-β-methyl-γ-phenyl-, (βS)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 467.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.9±3.0 kJ/mol
Flash Point: 236.6±27.3 °C
Index of Refraction: 1.615
Molar Refractivity: 102.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.05
ACD/LogD (pH 5.5): 5.88
ACD/BCF (pH 5.5): 17385.44
ACD/KOC (pH 5.5): 37732.20
ACD/LogD (pH 7.4): 5.88
ACD/BCF (pH 7.4): 17385.44
ACD/KOC (pH 7.4): 37732.20
Polar Surface Area: 20 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 46.2±3.0 dyne/cm
Molar Volume: 294.4±3.0 cm3

Click to predict properties on the Chemicalize site


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