| CAS Number | 1196156-69-0 |
| Catalog Number | AG008WTH |
| Chemical Name | 2-Chloro-3-ethynylpyridine |
| IUPAC Name | 2-chloro-3-ethynylpyridine |
| InChI | InChI=1S/C7H4ClN/c1-2-6-4-3-5-9-7(6)8/h1,3-5H |
| InChI Key | QDXBYAHLSUVKHT-UHFFFAOYSA-N |
| MDL Number | MFCD13189764 |
| Molecular Formula | C7H4ClN |
| Molecular Weight | 137.5664 |
| SMILES | C#CC1=C(Cl)N=CC=C1 |
| Synonyms | 2-chloro-3-ethynylpyridine,
1196156-69-0,
SCHEMBL5700564,
Pyridine, 2-chloro-3-ethynyl-,
DTXSID10603824,
ZINC59438220,
AKOS026716019,
AB69069,
F-1187,
F2147-2794,
|
| Complexity | 135 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 137.003g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 137.566g/mol |
| Monoisotopic Mass | 137.003g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number