ChemSpider 2D Image | 8,9-Dibromo-4-[4-(3-methylphenoxy)phenyl]-4-azatricyclo[5.2.1.0~2,6~]decane-3,5-dione | C22H19Br2NO3

8,9-Dibromo-4-[4-(3-methylphenoxy)phenyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione

  • Molecular FormulaC22H19Br2NO3
  • Average mass505.199 Da
  • Monoisotopic mass502.973145 Da
  • ChemSpider ID2699253

More details:

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

4,7-Methano-1H-isoindole-1,3(2H)-dione, 5,6-dibromohexahydro-2-[4-(3-methylphenoxy)phenyl]- [ACD/Index Name]
8,9-Dibrom-4-[4-(3-methylphenoxy)phenyl]-4-azatricyclo[5.2.1.02,6]decan-3,5-dion [German] [ACD/IUPAC Name]
8,9-Dibromo-4-[4-(3-methylphenoxy)phenyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione [ACD/IUPAC Name]
8,9-Dibromo-4-[4-(3-méthylphénoxy)phényl]-4-azatricyclo[5.2.1.02,6]décane-3,5-dione [French] [ACD/IUPAC Name]
488786-55-6 [RN]
5,6-dibromo-2-[4-(3-methylphenoxy)phenyl]hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
5,6-dibromo-2-[4-(3-methylphenoxy)phenyl]hexahydro-1H-4,7-methanoisoindole-1,3-dione
AC1MQT6T
AGN-PC-05Y92L
AKOS003244932
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AK-918/12272210 [DBID]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 643.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.0±3.0 kJ/mol
Flash Point: 343.1±31.5 °C
Index of Refraction: 1.666
Molar Refractivity: 112.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 4.87
ACD/BCF (pH 5.5): 2960.13
ACD/KOC (pH 5.5): 10625.75
ACD/LogD (pH 7.4): 4.87
ACD/BCF (pH 7.4): 2960.13
ACD/KOC (pH 7.4): 10625.75
Polar Surface Area: 47 Å2
Polarizability: 44.7±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 303.3±3.0 cm3

Click to predict properties on the Chemicalize site


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