| CAS Number | 125734-49-8 |
| Catalog Number | AG009WZW(AGN-PC-0WP1QF) |
| Chemical Name | 2-Pyridinecarboxylic acid, 5-(dimethoxymethyl)-, methyl ester |
| IUPAC Name | methyl 5-(dimethoxymethyl)pyridine-2-carboxylate |
| InChI | InChI=1S/C10H13NO4/c1-13-9(12)8-5-4-7(6-11-8)10(14-2)15-3/h4-6,10H,1-3H3 |
| InChI Key | JHFUIEBNXZAMMC-UHFFFAOYSA-N |
| MDL Number | MFCD22574961 |
| Molecular Formula | C10H13NO4 |
| Molecular Weight | 211.2145 |
| SMILES | COC(=O)c1ccc(cn1)C(OC)OC |
| Synonyms | methyl 5-(dimethoxymethyl)pyridine-2-carboxylate,
125734-49-8,
SCHEMBL9377198,
JHFUIEBNXZAMMC-UHFFFAOYSA-N,
ZINC34302136,
Z8974,
2-Pyridinecarboxylic acid, 5-(dimethoxymethyl)-, methyl ester,
C10H13NO4,
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| Complexity | 206 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.217g/mol |
| Monoisotopic Mass | 211.084g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 57.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number