| CAS Number | 1012058-77-3 |
| Catalog Number | AG0003Y3(AGN-PC-0D4KDA) |
| Chemical Name | 4-(4-Aminophenoxy)picolinic acid |
| IUPAC Name | 4-(4-aminophenoxy)pyridine-2-carboxylic acid |
| InChI | InChI=1S/C12H10N2O3/c13-8-1-3-9(4-2-8)17-10-5-6-14-11(7-10)12(15)16/h1-7H,13H2,(H,15,16) |
| InChI Key | GNHAPVOOPOBNLE-UHFFFAOYSA-N |
| MDL Number | MFCD23378603 |
| Molecular Formula | C12H10N2O3 |
| Molecular Weight | 230.2194 |
| SMILES | O=C(O)C1=NC=CC(OC2=CC=C(N)C=C2)=C1 |
| Synonyms | 4-(4-Aminophenoxy)picolinic acid,
1012058-77-3,
SCHEMBL4334161,
DTXSID60733009,
ZINC91301739,
AJ-129875,
AX8249077,
4-(4-aminophenoxy)pyridine-2-carboxylic acid,
2-Pyridinecarboxylic acid, 4-(4-aMinophenoxy)-,
4-(4-Amino-phenoxy)-pyridine-2-carboxylic acid,
A1-11981,
4-(4-Aminophenoxy)picolinicacid,
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| Complexity | 265 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.223g/mol |
| Monoisotopic Mass | 230.069g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 85.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number