| CAS Number | 92808-09-8 |
| Catalog Number | AG01BTZH(AGN-PC-00M5NP) |
| Chemical Name | 6-ethoxy-4-hydroxy-1,5-naphthyridine-3-carboxylic acid |
| IUPAC Name | 6-ethoxy-4-oxo-1H-1,5-naphthyridine-3-carboxylic acid |
| InChI | InChI=1S/C11H10N2O4/c1-2-17-8-4-3-7-9(13-8)10(14)6(5-12-7)11(15)16/h3-5H,2H2,1H3,(H,12,14)(H,15,16) |
| InChI Key | WDXGZPGBPUNRNK-UHFFFAOYSA-N |
| MDL Number | MFCD26383627 |
| Molecular Formula | C11H10N2O4 |
| Molecular Weight | 234.2081 |
| SMILES | CCOC1=NC2=C(N=CC(=C2O)C(O)=O)C=C1 |
| Synonyms | 92808-09-8,
6-Ethoxy-4-oxo-1,4-dihydro-1,5-naphthyridine-3-carboxylic acid,
AX8258806,
6-ethoxy-4-hydroxy-1,5-naphthyridine-3-carboxylic acid,
6-Ethoxy-1,4-dihydro-4-oxo-1,5-naphthyridine-3-carboxylic acid,
6-Ethoxy-4-oxo-1,4-dihydro-1,5-phthyridine-3-carboxylic acid,
SCHEMBL6448287,
SCHEMBL11035983,
DTXSID80537586,
WDXGZPGBPUNRNK-UHFFFAOYSA-N,
ZINC39615443,
AKOS022172202,
AKOS022658867,
AJ-100423,
|
| Complexity | 367 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 234.211g/mol |
| Monoisotopic Mass | 234.064g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 88.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number