ChemSpider 2D Image | N,N'-(1R,2S)-1,2-Cyclohexanediylbis[2-(2-bromo-4-methylphenoxy)acetamide] | C24H28Br2N2O4

N,N'-(1R,2S)-1,2-Cyclohexanediylbis[2-(2-bromo-4-methylphenoxy)acetamide]

  • Molecular FormulaC24H28Br2N2O4
  • Average mass568.298 Da
  • Monoisotopic mass566.041565 Da
  • ChemSpider ID874703

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Acetamide, N,N'-(1R,2S)-1,2-cyclohexanediylbis[2-(2-bromo-4-methylphenoxy)- [ACD/Index Name]
N,N'-(1R,2S)-1,2-Cyclohexandiylbis[2-(2-brom-4-methylphenoxy)acetamid] [German] [ACD/IUPAC Name]
N,N'-(1R,2S)-1,2-Cyclohexanediylbis[2-(2-bromo-4-methylphenoxy)acetamide] [ACD/IUPAC Name]
N,N'-(1R,2S)-1,2-Cyclohexanediylbis[2-(2-bromo-4-méthylphénoxy)acétamide] [French] [ACD/IUPAC Name]

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

ZINC00673732 [DBID]
ZINC00673739 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 754.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.0±3.0 kJ/mol
Flash Point: 410.3±32.9 °C
Index of Refraction: 1.620
Molar Refractivity: 131.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.31
ACD/LogD (pH 5.5): 4.98
ACD/BCF (pH 5.5): 3578.00
ACD/KOC (pH 5.5): 12169.98
ACD/LogD (pH 7.4): 4.98
ACD/BCF (pH 7.4): 3578.00
ACD/KOC (pH 7.4): 12169.97
Polar Surface Area: 77 Å2
Polarizability: 52.1±0.5 10-24cm3
Surface Tension: 57.8±5.0 dyne/cm
Molar Volume: 373.8±5.0 cm3

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