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ChemSpider 2D Image | 4-(6-methoxy-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)butanoic acid | C10H12N4O3

4-(6-methoxy-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)butanoic acid

  • Molecular FormulaC10H12N4O3
  • Average mass236.227 Da
  • Monoisotopic mass236.090942 Da
  • ChemSpider ID28943532

More details:

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

4-(6-Methoxy[1,2,4]triazolo[4,3-b]pyridazin-3-yl)butansäure [German] [ACD/IUPAC Name]
Acide 4-(6-méthoxy[1,2,4]triazolo[4,3-b]pyridazin-3-yl)butanoïque [French] [ACD/IUPAC Name]
1,2,4-Triazolo[4,3-b]pyridazine-3-butanoic acid, 6-methoxy- [ACD/Index Name]
1322605-17-3 [RN]
4-(6-methoxy-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)butanoic acid
4-(6-Methoxy[1,2,4]triazolo[4,3-b]pyridazin-3-yl)butanoic acid [ACD/IUPAC Name]
4-(6-Methoxy-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-butyric acid
4-{6-methoxy-[1,2,4]triazolo[4,3-b]pyridazin-3-yl}butanoic acid
Benzoic acid, 4-(aminomethyl)- (9CI)
MFCD19691832 [MDL number]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.658
Molar Refractivity: 59.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.12
ACD/LogD (pH 5.5): -0.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.88
ACD/LogD (pH 7.4): -2.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 90 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 58.5±7.0 dyne/cm
Molar Volume: 161.7±7.0 cm3

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