| CAS Number | 862088-69-5 |
| Catalog Number | AG01B6IN |
| Chemical Name | 6-(2-fluorophenoxy)pyridine-3-carboxylic acid |
| IUPAC Name | 6-(2-fluorophenoxy)pyridine-3-carboxylic acid |
| InChI | InChI=1S/C12H8FNO3/c13-9-3-1-2-4-10(9)17-11-6-5-8(7-14-11)12(15)16/h1-7H,(H,15,16) |
| InChI Key | OZZNBLMFROTCHT-UHFFFAOYSA-N |
| MDL Number | MFCD09736570 |
| Molecular Formula | C12H8FNO3 |
| Molecular Weight | 233.1952 |
| SMILES | OC(C1=CN=C(OC2=C(F)C=CC=C2)C=C1)=O |
| Synonyms | 6-(2-fluorophenoxy)pyridine-3-carboxylic acid,
862088-69-5,
SCHEMBL4252380,
CTK7C2581,
ZINC22215850,
AKOS000142308,
6-(2-FLUOROPHENOXY)NICOTINIC ACID,
Z1680795727,
|
| 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 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number