| CAS Number | 1267528-51-7 |
| Catalog Number | AG01BIOU |
| Chemical Name | 5-Isocyano-2-methoxypyridine |
| IUPAC Name | 5-isocyano-2-methoxypyridine |
| InChI | InChI=1S/C7H6N2O/c1-8-6-3-4-7(10-2)9-5-6/h3-5H,2H3 |
| InChI Key | ZHHPRLHIRZWXAQ-UHFFFAOYSA-N |
| MDL Number | MFCD28648545 |
| Molecular Formula | C7H6N2O |
| Molecular Weight | 134.1353 |
| SMILES | COC1=NC=C([N+]#[C-])C=C1 |
| Synonyms | 5-isocyano-2-methoxypyridine,
1267528-51-7,
Pyridine, 5-isocyano-2-methoxy-,
ZINC197469646,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 134.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 134.138g/mol |
| Monoisotopic Mass | 134.048g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number