| CAS Number | 1094025-00-9 |
| Catalog Number | AG01BD16 |
| Chemical Name | Methyl 3-propoxypyridine-2-carboxylate |
| IUPAC Name | methyl 3-propoxypyridine-2-carboxylate |
| InChI | InChI=1S/C10H13NO3/c1-3-7-14-8-5-4-6-11-9(8)10(12)13-2/h4-6H,3,7H2,1-2H3 |
| InChI Key | OBPFEJLGUCRRJB-UHFFFAOYSA-N |
| MDL Number | MFCD28012377 |
| Molecular Formula | C10H13NO3 |
| Molecular Weight | 195.2151 |
| SMILES | CCCOC1=C(C(OC)=O)N=CC=C1 |
| Synonyms | methyl 3-propyloxypicolinate,
methyl 3-propoxypyridine-2-carboxylate,
1094025-00-9,
SCHEMBL2450038,
OBPFEJLGUCRRJB-UHFFFAOYSA-N,
ZINC96300645,
|
| Complexity | 184 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.218g/mol |
| Monoisotopic Mass | 195.09g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 48.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number