ChemSpider 2D Image | AB-PINACA N-(4-fluoropentyl) isomer | C18H25FN4O2

AB-PINACA N-(4-fluoropentyl) isomer

  • Molecular FormulaC18H25FN4O2
  • Average mass348.415 Da
  • Monoisotopic mass348.196167 Da
  • ChemSpider ID30646776

More details:

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

1H-Indazole-3-carboxamide, N-[1-(aminocarbonyl)-2-methylpropyl]-1-(4-fluoropentyl)- [ACD/Index Name]
AB-PINACA N-(4-fluoropentyl) isomer
N-(1-Amino-3-methyl-1-oxo-2-butanyl)-1-(4-fluoropentyl)-1H-indazole-3-carboxamide [ACD/IUPAC Name]
N-(1-Amino-3-méthyl-1-oxo-2-butanyl)-1-(4-fluoropentyl)-1H-indazole-3-carboxamide [French] [ACD/IUPAC Name]
N-(1-Amino-3-methyl-1-oxo-2-butanyl)-1-(4-fluorpentyl)-1H-indazol-3-carboxamid [German] [ACD/IUPAC Name]
2-{[1-(4-FLUOROPENTYL)-1H-INDAZOL-3-YL]FORMAMIDO}-3-METHYLBUTANAMIDE
2-{[1-(4-FLUOROPENTYL)INDAZOL-3-YL]FORMAMIDO}-3-METHYLBUTANAMIDE
2748160-98-5 [RN]
N-(1-amino-3-methyl-1-oxobutan-2-yl)-1-(4-fluoropentyl)-1H-indazole-3-carboxamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 601.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.5±3.0 kJ/mol
Flash Point: 317.7±28.7 °C
Index of Refraction: 1.589
Molar Refractivity: 93.4±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.21
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 25.11
ACD/KOC (pH 5.5): 349.60
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 25.09
ACD/KOC (pH 7.4): 349.36
Polar Surface Area: 90 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 43.0±7.0 dyne/cm
Molar Volume: 277.1±7.0 cm3

Click to predict properties on the Chemicalize site


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