| CAS Number | 1824472-05-0 |
| Catalog Number | AG01DZ3O |
| Chemical Name | 3-ethynyl-6-fluoro-2-methylpyridine |
| IUPAC Name | 3-ethynyl-6-fluoro-2-methylpyridine |
| InChI | InChI=1S/C8H6FN/c1-3-7-4-5-8(9)10-6(7)2/h1,4-5H,2H3 |
| InChI Key | SZSRNAMTWDFWOY-UHFFFAOYSA-N |
| MDL Number | MFCD22190120 |
| Molecular Formula | C8H6FN |
| Molecular Weight | 135.1383 |
| SMILES | CC1=C(C#C)C=CC(F)=N1 |
| Synonyms | 3-ethynyl-6-fluoro-2-methylpyridine,
1824472-05-0,
F-5075,
|
| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 135.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 135.141g/mol |
| Monoisotopic Mass | 135.048g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number