| CAS Number | 863032-31-9 |
| Catalog Number | AG00IE05(AGN-PC-0WBSLM) |
| Chemical Name | methyl 2-(pyridazin-4-yl)acetate |
| IUPAC Name | methyl 2-pyridazin-4-ylacetate |
| InChI | InChI=1S/C7H8N2O2/c1-11-7(10)4-6-2-3-8-9-5-6/h2-3,5H,4H2,1H3 |
| InChI Key | KVEYLMIGFBBEHX-UHFFFAOYSA-N |
| MDL Number | MFCD17015883 |
| Molecular Formula | C7H8N2O2 |
| Molecular Weight | 152.1506 |
| SMILES | COC(=O)Cc1ccnnc1 |
| Synonyms | 863032-31-9,
METHYL 2-(PYRIDAZIN-4-YL)ACETATE,
METHYL PYRIDAZIN-4-YL-ACETATE,
Methyl 2-pyridazin-4-ylacetate,
MFCD17015883,
ZINC95708160,
4-Pyridazineacetic acid, methyl ester,
AKOS025146807,
FCH1149890,
PB28638,
KS-000002Z1,
AK165280,
AS-33454,
ST1130931,
CS-0049197,
Q-3852,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 152.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 152.153g/mol |
| Monoisotopic Mass | 152.059g/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
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number