ChemSpider 2D Image | 2-(7-Amino-4,5-dioxo-1,4,5,6-tetrahydropyrimido[4,5-c]pyridazin-3-yl)propanoic acid | C9H9N5O4

2-(7-Amino-4,5-dioxo-1,4,5,6-tetrahydropyrimido[4,5-c]pyridazin-3-yl)propanoic acid

  • Molecular FormulaC9H9N5O4
  • Average mass251.199 Da
  • Monoisotopic mass251.065460 Da
  • ChemSpider ID34226218

More details:






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

1374603-50-5 [RN]
2-(7-Amino-4,5-dioxo-1,4,5,6-tetrahydropyrimido[4,5-c]pyridazin-3-yl)propanoic acid [ACD/IUPAC Name]
2-(7-Amino-4,5-dioxo-1,4,5,6-tetrahydropyrimido[4,5-c]pyridazin-3-yl)propansäure [German] [ACD/IUPAC Name]
Acide 2-(7-amino-4,5-dioxo-1,4,5,6-tétrahydropyrimido[4,5-c]pyridazin-3-yl)propanoïque [French] [ACD/IUPAC Name]
Pyrimido[4,5-c]pyridazine-3-acetic acid, 7-amino-1,4,5,6-tetrahydro-α-methyl-4,5-dioxo-
Pyrimido[4,5-c]pyridazine-3-acetic acid, 7-amino-1,4,5,6-tetrahydro-α-methyl-4,5-dioxo- [ACD/Index Name]

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.865
Molar Refractivity: 56.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -2.88
ACD/LogD (pH 5.5): -3.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 146 Å2
Polarizability: 22.3±0.5 10-24cm3
Surface Tension: 100.2±7.0 dyne/cm
Molar Volume: 124.4±7.0 cm3

Click to predict properties on the Chemicalize site






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