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Search term: VEVITSUXBQZDFS-LURJTMIESA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 4-Chloro-2-methyl-5-[(3S)-3-pyrrolidinylamino]-3(2H)-pyridazinone | C9H13ClN4O

4-Chloro-2-methyl-5-[(3S)-3-pyrrolidinylamino]-3(2H)-pyridazinone

  • Molecular FormulaC9H13ClN4O
  • Average mass228.679 Da
  • Monoisotopic mass228.077789 Da
  • ChemSpider ID129223161

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

3(2H)-Pyridazinone, 4-chloro-2-methyl-5-[(3S)-3-pyrrolidinylamino]- [ACD/Index Name]
4-Chlor-2-methyl-5-[(3S)-3-pyrrolidinylamino]-3(2H)-pyridazinon [German] [ACD/IUPAC Name]
4-Chloro-2-methyl-5-[(3S)-3-pyrrolidinylamino]-3(2H)-pyridazinone [ACD/IUPAC Name]
4-Chloro-2-méthyl-5-[(3S)-3-pyrrolidinylamino]-3(2H)-pyridazinone [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 325.9±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.8±3.0 kJ/mol
Flash Point: 150.9±30.7 °C
Index of Refraction: 1.683
Molar Refractivity: 57.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.97
ACD/LogD (pH 5.5): -3.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 57 Å2
Polarizability: 22.7±0.5 10-24cm3
Surface Tension: 55.6±7.0 dyne/cm
Molar Volume: 151.1±7.0 cm3

Click to predict properties on the Chemicalize site


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