6-Amino-4-pyridazinecarboxylic Acid - CAS 1242458-49-6
Catalog: |
BB074495 |
Product Name: |
6-Amino-4-pyridazinecarboxylic Acid |
CAS: |
1242458-49-6 |
Synonyms: |
6-aminopyridazine-4-carboxylic acid; 4-Pyridazinecarboxylic acid, 6-amino-; 6-aminopyridazine-4-carboxylicacid; 6-amino-4-Pyridazinecarboxylic acid |
IUPAC Name: | 6-aminopyridazine-4-carboxylic acid |
Molecular Weight: | 139.11 |
Molecular Formula: | C5H5N3O2 |
Canonical SMILES: | C1=C(C=NN=C1N)C(=O)O |
InChI: | InChI=1S/C5H5N3O2/c6-4-1-3(5(9)10)2-7-8-4/h1-2H,(H2,6,8)(H,9,10) |
InChI Key: | SNLGFUZBTYAQLN-UHFFFAOYSA-N |
Complexity: | 139 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 139.038176411 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 139.038176411 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 89.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1 |
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