Cas no 939411-47-9 (1-Cyclopentyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid)

1-Cyclopentyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid structure
939411-47-9 structure
Product Name:1-Cyclopentyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid
CAS No:939411-47-9
MF:C10H12N2O3
MW:208.213882446289
CID:2120628
Update Time:2023-08-04

1-Cyclopentyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1-cyclopentyl-1,6-dihydro-6-oxo-3-Pyridazinecarboxylic acid
    • OXSALPKJCLLCGI-UHFFFAOYSA-N
    • 3-Pyridazinecarboxylic acid, 1-cyclopentyl-1,6-dihydro-6-oxo-
    • 1-cyclopentyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid
    • 3-Pyridazinecarboxylicacid,1-cyclopentyl-1,6-dihydro-6-oxo-
    • 1-Cyclopentyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid
    • Inchi: 1S/C10H12N2O3/c13-9-6-5-8(10(14)15)11-12(9)7-3-1-2-4-7/h5-7H,1-4H2,(H,14,15)
    • InChI Key: OXSALPKJCLLCGI-UHFFFAOYSA-N
    • SMILES: O=C1C=CC(C(=O)O)=NN1C1CCCC1

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 354
  • Topological Polar Surface Area: 70
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