| CAS Number | 914452-70-3 |
| Catalog Number | AG00GYOL |
| Chemical Name | 2-Iodo-5-methylpyrazine |
| IUPAC Name | 2-iodo-5-methylpyrazine |
| InChI | InChI=1S/C5H5IN2/c1-4-2-8-5(6)3-7-4/h2-3H,1H3 |
| InChI Key | CLNBOXAAONTXKB-UHFFFAOYSA-N |
| MDL Number | MFCD08705755 |
| Molecular Formula | C5H5IN2 |
| Molecular Weight | 220.0111 |
| SMILES | CC1=CN=C(I)C=N1 |
| Synonyms | 2-IODO-5-METHYLPYRAZINE,
914452-70-3,
SCHEMBL6090433,
CTK5G9652,
DTXSID00623738,
MFCD08705755,
ZINC95932377,
QC-6833,
AJ-137533,
CS-0059962,
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| Complexity | 76.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.95g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.013g/mol |
| Monoisotopic Mass | 219.95g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number