Found 819 results

Search term: MF = 'C_{20}H_{21}ClFN_{3}O_{3}'
ChemSpider 2D Image | Ethyl 1-allyl-5-[(2-chloro-6-fluorophenyl)acetyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxylate | C20H21ClFN3O3

Ethyl 1-allyl-5-[(2-chloro-6-fluorophenyl)acetyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxylate

  • Molecular FormulaC20H21ClFN3O3
  • Average mass405.850 Da
  • Monoisotopic mass405.125549 Da
  • ChemSpider ID22183899

More details:

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

1-Allyl-5-[2-(2-chloro-6-fluorophényl)acétyl]-4,5,6,7-tétrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
1H-Pyrazolo[4,3-c]pyridine-3-carboxylic acid, 5-[2-(2-chloro-6-fluorophenyl)acetyl]-4,5,6,7-tetrahydro-1-(2-propen-1-yl)-, ethyl ester [ACD/Index Name]
Ethyl 1-allyl-5-[(2-chloro-6-fluorophenyl)acetyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxylate [ACD/IUPAC Name]
Ethyl-1-allyl-5-[(2-chlor-6-fluorphenyl)acetyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 596.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.9±3.0 kJ/mol
Flash Point: 314.5±30.1 °C
Index of Refraction: 1.602
Molar Refractivity: 105.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.63
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 448.11
ACD/KOC (pH 5.5): 2750.85
ACD/LogD (pH 7.4): 3.79
ACD/BCF (pH 7.4): 448.11
ACD/KOC (pH 7.4): 2750.85
Polar Surface Area: 64 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 45.1±7.0 dyne/cm
Molar Volume: 306.7±7.0 cm3

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