| CAS Number | 1343658-77-4 |
| Catalog Number | AG018RVO(AGN-PC-0WO9UO) |
| Chemical Name | 5-(2-methoxyethoxy)pyridine-3-carboxylic acid |
| IUPAC Name | 5-(2-methoxyethoxy)pyridine-3-carboxylic acid |
| InChI | InChI=1S/C9H11NO4/c1-13-2-3-14-8-4-7(9(11)12)5-10-6-8/h4-6H,2-3H2,1H3,(H,11,12) |
| InChI Key | XMAJPEYOVOZTFG-UHFFFAOYSA-N |
| MDL Number | MFCD18898173 |
| Molecular Formula | C9H11NO4 |
| Molecular Weight | 197.1879 |
| SMILES | COCCOC1=CN=CC(=C1)C(=O)O |
| Synonyms | 1343658-77-4,
5-(2-methoxyethoxy)pyridine-3-carboxylic acid,
5-(2-Methoxyethoxy)nicotinic acid,
5-(2-Methoxyethoxy)pyridine-3-carboxylicacid,
ZINC82644066,
AKOS013164102,
KS-7436,
MCULE-8282199380,
NE16405,
F8881-0391,
Z1741785973,
|
| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.19g/mol |
| Monoisotopic Mass | 197.069g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 68.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
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Certificate of Analysis
Lot Number