| CAS Number | 92929-53-8 |
| Catalog Number | AG006K1K(AGN-PC-0WCKHO) |
| Chemical Name | 4-Pyridazinecarboxylic acid, 5-methyl-, ethyl ester |
| IUPAC Name | ethyl 5-methylpyridazine-4-carboxylate |
| InChI | InChI=1S/C8H10N2O2/c1-3-12-8(11)7-5-10-9-4-6(7)2/h4-5H,3H2,1-2H3 |
| InChI Key | IXOIGNZETIAWGN-UHFFFAOYSA-N |
| MDL Number | MFCD17016066 |
| Molecular Formula | C8H10N2O2 |
| Molecular Weight | 166.1772 |
| SMILES | CC=1C(=CN=NC1)C(=O)OCC |
| Synonyms | 92929-53-8,
5-METHYL-PYRIDAZINE-4-CARBOXYLIC ACID ETHYL ESTER,
4-Pyridazinecarboxylic acid, 5-methyl-, ethyl ester,
ETHYL 5-METHYLPYRIDAZINE-4-CARBOXYLATE,
ACMC-20lwtr,
SCHEMBL352645,
CTK3G9815,
DTXSID90532845,
IXOIGNZETIAWGN-UHFFFAOYSA-N,
MFCD17016066,
ZINC39437033,
AKOS025403963,
PB27094,
CS-0055253,
Q-3995,
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| Complexity | 161 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.18g/mol |
| Monoisotopic Mass | 166.074g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number