| CAS Number | 1522520-75-7 |
| Catalog Number | AG01C2EP |
| Chemical Name | 5-(3-Fluorophenoxy)pyridine-2-carboxylic acid |
| IUPAC Name | 5-(3-fluorophenoxy)pyridine-2-carboxylic acid |
| InChI | InChI=1S/C12H8FNO3/c13-8-2-1-3-9(6-8)17-10-4-5-11(12(15)16)14-7-10/h1-7H,(H,15,16) |
| InChI Key | GQJXCHFGPIEVCM-UHFFFAOYSA-N |
| MDL Number | MFCD23665452 |
| Molecular Formula | C12H8FNO3 |
| Molecular Weight | 233.1952 |
| SMILES | OC(C1=NC=C(OC2=CC(F)=CC=C2)C=C1)=O |
| Synonyms | 5-(3-fluorophenoxy)pyridine-2-carboxylic acid,
1522520-75-7,
ZINC84037319,
AKOS023374050,
Z1680798006,
|
| Complexity | 275 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.198g/mol |
| Monoisotopic Mass | 233.049g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 59.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
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