| CAS Number | 476623-12-8 |
| Catalog Number | AG01FR24(AGN-PC-0OAMOU) |
| Chemical Name | 5-Chloro-2-iodo-3-methoxy-pyrazine |
| IUPAC Name | 5-chloro-2-iodo-3-methoxypyrazine |
| InChI | InChI=1S/C5H4ClIN2O/c1-10-5-4(7)8-2-3(6)9-5/h2H,1H3 |
| InChI Key | RSGSCNBTJMOTKU-UHFFFAOYSA-N |
| MDL Number | MFCD29761239 |
| Molecular Formula | C5H4ClIN2O |
| Molecular Weight | 270.4555 |
| SMILES | COc1nc(Cl)cnc1I |
| Synonyms | 5-Chloro-2-iodo-3-methoxypyrazine,
476623-12-8,
ZINC299889970,
FCH4007913,
AX8271533,
|
| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 269.90569g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.45g/mol |
| Monoisotopic Mass | 269.90569g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number