| CAS Number | 864866-44-4 |
| Catalog Number | AG003977(AGN-PC-03ZCTX) |
| Chemical Name | 7-Iodo-[1,2,4]triazolo[4,3-a]pyridine |
| IUPAC Name | 7-iodo-[1,2,4]triazolo[4,3-a]pyridine |
| InChI | InChI=1S/C6H4IN3/c7-5-1-2-10-4-8-9-6(10)3-5/h1-4H |
| InChI Key | KQTSOSULAYFHBH-UHFFFAOYSA-N |
| MDL Number | MFCD27921215 |
| Molecular Formula | C6H4IN3 |
| Molecular Weight | 245.0205 |
| SMILES | IC1=CC=2N(C=C1)C=NN2 |
| Synonyms | 7-Iodo-[1,2,4]triazolo[4,3-a]pyridine,
864866-44-4,
1,2,4-Triazolo[4,3-a]pyridine, 7-iodo-,
SCHEMBL1500104,
KQTSOSULAYFHBH-UHFFFAOYSA-N,
MFCD27921215,
ZINC59864404,
FCH2495684,
AJ-113752,
AX8288817,
CS-0085155,
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| Complexity | 130 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.945g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.023g/mol |
| Monoisotopic Mass | 244.945g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 30.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
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Certificate of Analysis
Lot Number