ChemSpider 2D Image | UR-144 N-(5-chloropentyl) analog | C21H28ClNO

UR-144 N-(5-chloropentyl) analog

  • Molecular FormulaC21H28ClNO
  • Average mass345.906 Da
  • Monoisotopic mass345.185944 Da
  • ChemSpider ID29341421

More details:






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

[1-(5-Chloropentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)methanone [ACD/IUPAC Name]
[1-(5-Chloropentyl)-1H-indol-3-yl](2,2,3,3-tétraméthylcyclopropyl)méthanone [French] [ACD/IUPAC Name]
[1-(5-Chlorpentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)methanon [German] [ACD/IUPAC Name]
1445577-42-3 [RN]
Methanone, [1-(5-chloropentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)- [ACD/Index Name]
UR-144 N-(5-chloropentyl) analog
(1-(5-chloropentyl)-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone
[1-(5-chloropentyl)indol-3-yl]-(2,2,3,3-tetramethylcyclopropyl)methanone

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

120SQ2FIK4 [DBID]
UNII:120SQ2FIK4 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 465.6±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.7±3.0 kJ/mol
Flash Point: 235.4±23.2 °C
Index of Refraction: 1.569
Molar Refractivity: 101.4±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.81
ACD/LogD (pH 5.5): 6.07
ACD/BCF (pH 5.5): 24202.84
ACD/KOC (pH 5.5): 47814.20
ACD/LogD (pH 7.4): 6.07
ACD/BCF (pH 7.4): 24202.84
ACD/KOC (pH 7.4): 47814.20
Polar Surface Area: 22 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 38.0±7.0 dyne/cm
Molar Volume: 309.7±7.0 cm3

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