| CAS Number | 98197-84-3 |
| Catalog Number | AG018BCE(AGN-PC-0WBQ54) |
| Chemical Name | (Pyridazin-3-yloxy)acetic acid |
| IUPAC Name | 2-pyridazin-3-yloxyacetic acid |
| InChI | InChI=1S/C6H6N2O3/c9-6(10)4-11-5-2-1-3-7-8-5/h1-3H,4H2,(H,9,10) |
| InChI Key | PKQBTLBHZQOIBC-UHFFFAOYSA-N |
| MDL Number | MFCD06260680 |
| Molecular Formula | C6H6N2O3 |
| Molecular Weight | 154.1234 |
| SMILES | OC(COC1=NN=CC=C1)=O |
| Synonyms | (pyridazin-3-yloxy)acetic acid,
98197-84-3,
2-(3-pyridazinyloxy)Acetic acid,
2-(pyridazin-3-yloxy)acetic acid,
2-pyridazin-3-yloxyacetic Acid,
3-Carboxymethoxyl-pyridazin,
AC1O4VR0,
SCHEMBL361395,
DTXSID60423519,
ZINC26420245,
AKOS002685312,
MCULE-3500815204,
DA-00094,
AB0168087,
FT-0713157,
L-4231,
F1967-0174,
CID6418485,
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| Complexity | 140 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 154.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 154.125g/mol |
| Monoisotopic Mass | 154.038g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 72.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number