| CAS Number | 168844-45-9 |
| Catalog Number | AG01C1YW(AGN-PC-0WP11Q) |
| Chemical Name | 2-(Pyridin-2-yloxy)propanoic acid |
| IUPAC Name | 2-pyridin-2-yloxypropanoic acid |
| InChI | InChI=1S/C8H9NO3/c1-6(8(10)11)12-7-4-2-3-5-9-7/h2-6H,1H3,(H,10,11) |
| InChI Key | INLOHHUITHYIOO-UHFFFAOYSA-N |
| MDL Number | MFCD07364005 |
| Molecular Formula | C8H9NO3 |
| Molecular Weight | 167.1620 |
| SMILES | CC(C(O)=O)OC1=NC=CC=C1 |
| Synonyms | 2-(pyridin-2-yloxy)propanoic acid,
168844-45-9,
SCHEMBL5517722,
2-(2-Pyridyloxy)propanoic acid,
AKOS034230804,
ACN-036182,
CS-0079975,
Z360507460,
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| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.058g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.164g/mol |
| Monoisotopic Mass | 167.058g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 59.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
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Certificate of Analysis
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