| CAS Number | 1401685-43-5 |
| Catalog Number | AG00HVRL(AGN-PC-0WQX2F) |
| Chemical Name | 2-Ethynyl-3-fluoropyridine |
| IUPAC Name | 2-ethynyl-3-fluoropyridine |
| InChI | InChI=1S/C7H4FN/c1-2-7-6(8)4-3-5-9-7/h1,3-5H |
| InChI Key | WKCSIVACSVNZLD-UHFFFAOYSA-N |
| MDL Number | MFCD22191371 |
| Molecular Formula | C7H4FN |
| Molecular Weight | 121.1118 |
| SMILES | C#Cc1ncccc1F |
| Synonyms | 2-ethynyl-3-fluoropyridine,
1401685-43-5,
Pyridine, 2-ethynyl-3-fluoro-,
SCHEMBL5022136,
ZINC95616334,
CS-0090831,
F-5022,
F2167-2840,
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| Complexity | 135 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 121.033g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 121.114g/mol |
| Monoisotopic Mass | 121.033g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
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Certificate of Analysis
Lot Number