ChemSpider 2D Image | N-(5-BROMOPENTYL) UR-144 | C21H28BrNO

N-(5-BROMOPENTYL) UR-144

  • Molecular FormulaC21H28BrNO
  • Average mass390.357 Da
  • Monoisotopic mass389.135406 Da
  • ChemSpider ID29341419

More details:






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

[1-(5-Bromopentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)methanone [ACD/IUPAC Name]
[1-(5-Bromopentyl)-1H-indol-3-yl](2,2,3,3-tétraméthylcyclopropyl)méthanone [French] [ACD/IUPAC Name]
[1-(5-Brompentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)methanon [German] [ACD/IUPAC Name]
1628690-26-5 [RN]
Methanone, [1-(5-bromopentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)- [ACD/Index Name]
N-(5-BROMOPENTYL) UR-144
(1-(5-bromopentyl)-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone
[1-(5-bromopentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)-methanone
[1-(5-bromopentyl)indol-3-yl]-(2,2,3,3-tetramethylcyclopropyl)methanone
UR-144 N-(5-bromopentyl) analog

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

7K5H7NIL5F [DBID]
UNII:7K5H7NIL5F [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 477.8±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.2±3.0 kJ/mol
Flash Point: 242.7±23.2 °C
Index of Refraction: 1.581
Molar Refractivity: 104.4±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.99
ACD/LogD (pH 5.5): 6.18
ACD/BCF (pH 5.5): 29211.24
ACD/KOC (pH 5.5): 54704.77
ACD/LogD (pH 7.4): 6.18
ACD/BCF (pH 7.4): 29211.24
ACD/KOC (pH 7.4): 54704.77
Polar Surface Area: 22 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 39.3±7.0 dyne/cm
Molar Volume: 313.0±7.0 cm3

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