| CAS Number | 28232-35-1 |
| Catalog Number | AG00I5B0(AGN-PC-0WG43T) |
| Chemical Name | 2-Methyl-3-nitro-6-phenoxypyridine |
| IUPAC Name | 2-methyl-3-nitro-6-phenoxypyridine |
| InChI | InChI=1S/C12H10N2O3/c1-9-11(14(15)16)7-8-12(13-9)17-10-5-3-2-4-6-10/h2-8H,1H3 |
| InChI Key | YVBSKZKMHJBACA-UHFFFAOYSA-N |
| MDL Number | MFCD28991939 |
| Molecular Formula | C12H10N2O3 |
| Molecular Weight | 230.2194 |
| SMILES | c1(c(nc(cc1)Oc1ccccc1)C)[N+](=O)[O-] |
| Synonyms | 2-Methyl-3-nitro-6-phenoxypyridine,
28232-35-1,
SCHEMBL18956900,
MFCD28991939,
AKOS027255806,
ZINC261508988,
CS-0036453,
|
| Complexity | 261 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.223g/mol |
| Monoisotopic Mass | 230.069g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number