| CAS Number | 944903-36-0 |
| Catalog Number | AG00II9J(AGN-PC-0WQVM0) |
| Chemical Name | 3-(6-Methoxypyridin-2-yl)propanoic acid |
| IUPAC Name | 3-(6-methoxypyridin-2-yl)propanoic acid |
| InChI | InChI=1S/C9H11NO3/c1-13-8-4-2-3-7(10-8)5-6-9(11)12/h2-4H,5-6H2,1H3,(H,11,12) |
| InChI Key | SOKYGEMGIBOLIQ-UHFFFAOYSA-N |
| MDL Number | MFCD10698169 |
| Molecular Formula | C9H11NO3 |
| Molecular Weight | 181.1885 |
| SMILES | COC1=NC(CCC(O)=O)=CC=C1 |
| Synonyms | 3-(6-METHOXYPYRIDIN-2-YL)PROPANOIC ACID,
944903-36-0,
MFCD10698169,
ZINC78676139,
AKOS006303912,
AB61453,
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| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.191g/mol |
| Monoisotopic Mass | 181.074g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 59.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
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Certificate of Analysis
Lot Number