| CAS Number | 1372103-91-7 |
| Catalog Number | AG009FPR(AGN-PC-0WNWA3) |
| Chemical Name | 2-Ethynyl-3-Fluoro-5-Methylpyridine |
| IUPAC Name | 2-ethynyl-3-fluoro-5-methylpyridine |
| InChI | InChI=1S/C8H6FN/c1-3-8-7(9)4-6(2)5-10-8/h1,4-5H,2H3 |
| InChI Key | RRWWIECDYMJKNF-UHFFFAOYSA-N |
| MDL Number | MFCD21648441 |
| Molecular Formula | C8H6FN |
| Molecular Weight | 135.1383 |
| SMILES | C#CC1=C(C=C(C)C=N1)F |
| Synonyms | 2-ethynyl-3-fluoro-5-methylpyridine,
1372103-91-7,
6-Ethynyl-5-fluoro-3-picoline,
ZX-AP001512,
MFCD21648441,
ZINC72265841,
AKOS030530106,
FCH1566489,
PC49136,
PS-11833,
(3-Fluoro-5-methylpyridin-2-yl)acetylene,
F-1143,
F2167-5051,
2-ethynyl-3-fluoro-5-methylpyridine, 95% - 1G 1g,
|
| 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 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number