| CAS Number | 939428-15-6 |
| Catalog Number | AG006APD(AGN-PC-0J0XOG) |
| Chemical Name | 2-Methoxy-5-(3-nitrophenyl)pyridine |
| IUPAC Name | 2-methoxy-5-(3-nitrophenyl)pyridine |
| InChI | InChI=1S/C12H10N2O3/c1-17-12-6-5-10(8-13-12)9-3-2-4-11(7-9)14(15)16/h2-8H,1H3 |
| InChI Key | JTXKPXRKYGEWHT-UHFFFAOYSA-N |
| MDL Number | MFCD21333115 |
| Molecular Formula | C12H10N2O3 |
| Molecular Weight | 230.2194 |
| SMILES | COc1ccc(cn1)c1cccc(c1)[N+](=O)[O-] |
| Synonyms | 2-Methoxy-5-(3-nitrophenyl)pyridine,
939428-15-6,
ACMC-209ro8,
CTK8B2726,
DTXSID30743110,
ANW-40134,
MFCD21333115,
ZINC85483714,
CJ-22522,
TC-128879,
V9331,
B-9728,
C12H10N2O3,
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| Complexity | 267 |
| 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 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number