| CAS Number | 250674-48-7 |
| Catalog Number | AG002QCV(AGN-PC-0WCJA5) |
| Chemical Name | 2,7-naphthyridine-3-carboxylic acid |
| IUPAC Name | 2,7-naphthyridine-3-carboxylic acid |
| InChI | InChI=1S/C9H6N2O2/c12-9(13)8-3-6-1-2-10-4-7(6)5-11-8/h1-5H,(H,12,13) |
| InChI Key | REGNBBZZTQVCJU-UHFFFAOYSA-N |
| MDL Number | MFCD17015928 |
| Molecular Formula | C9H6N2O2 |
| Molecular Weight | 174.1561 |
| SMILES | O=C(C1=CC2=C(C=N1)C=NC=C2)O |
| Synonyms | 2,7-NAPHTHYRIDINE-3-CARBOXYLIC ACID,
250674-48-7,
SCHEMBL212751,
CHEMBL312934,
2,7-Naphthyridine-3-carbo...,
2,7-Naphthyridine-3-carboxylicacid,
MFCD17015928,
ZINC26576239,
AKOS022710055,
FCH1189383,
PB22836,
KS-0000038D,
AK165445,
AS-33540,
CS-0052127,
Q-3990,
|
| Complexity | 208 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.159g/mol |
| Monoisotopic Mass | 174.043g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 63.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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-P280-P301+P312-P302+P352-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number