Found 90 results

Search term: MF = 'C_{19}H_{21}BrN_{2}'
ChemSpider 2D Image | 1-(4'-Bromo-4-biphenylyl)-5-methyloctahydropyrrolo[3,4-b]pyrrole | C19H21BrN2

1-(4'-Bromo-4-biphenylyl)-5-methyloctahydropyrrolo[3,4-b]pyrrole

  • Molecular FormulaC19H21BrN2
  • Average mass357.287 Da
  • Monoisotopic mass356.088806 Da
  • ChemSpider ID24623299

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-(4'-Brom-4-biphenylyl)-5-methyloctahydropyrrolo[3,4-b]pyrrol [German] [ACD/IUPAC Name]
1-(4'-Bromo-4-biphenylyl)-5-methyloctahydropyrrolo[3,4-b]pyrrole [ACD/IUPAC Name]
1-(4'-Bromo-4-biphénylyl)-5-méthyloctahydropyrrolo[3,4-b]pyrrole [French] [ACD/IUPAC Name]
Pyrrolo[3,4-b]pyrrole, 1-(4'-bromo[1,1'-biphenyl]-4-yl)octahydro-5-methyl- [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: 471.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.5±3.0 kJ/mol
Flash Point: 239.2±25.9 °C
Index of Refraction: 1.613
Molar Refractivity: 94.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.63
ACD/LogD (pH 5.5): 1.63
ACD/BCF (pH 5.5): 1.63
ACD/KOC (pH 5.5): 5.67
ACD/LogD (pH 7.4): 2.75
ACD/BCF (pH 7.4): 21.87
ACD/KOC (pH 7.4): 76.00
Polar Surface Area: 6 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 43.9±3.0 dyne/cm
Molar Volume: 270.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement