| CAS Number | 80912-11-4 |
| Catalog Number | AG0050RZ(AGN-PC-00LHWC) |
| Chemical Name | 8-Methoxy-6-nitroquinoline |
| IUPAC Name | 8-methoxy-6-nitroquinoline |
| InChI | InChI=1S/C10H8N2O3/c1-15-9-6-8(12(13)14)5-7-3-2-4-11-10(7)9/h2-6H,1H3 |
| InChI Key | DDZOFSUAHDCNQO-UHFFFAOYSA-N |
| MDL Number | MFCD03086084 |
| Molecular Formula | C10H8N2O3 |
| Molecular Weight | 204.1821 |
| SMILES | COC=1C=C(C=C2C=CC=NC12)[N+](=O)[O-] |
| Synonyms | 8-methoxy-6-nitroquinoline,
80912-11-4,
Quinoline, 8-methoxy-6-nitro-,
SCHEMBL5865168,
CTK3E4994,
DTXSID40528450,
ZINC2506122,
MFCD03086084,
AKOS000133291,
(2S,5R)-1-Boc-2,5-dimethylpiperazine,
548762-66-9,
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| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.185g/mol |
| Monoisotopic Mass | 204.053g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 67.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number