8-Chloro-1,7-naphthyridine-6-carboxylic Acid - CAS 1019111-25-1
Catalog: |
BB070402 |
Product Name: |
8-Chloro-1,7-naphthyridine-6-carboxylic Acid |
CAS: |
1019111-25-1 |
Synonyms: |
8-chloro-1,7-naphthyridine-6-carboxylic acid; 8-chloro-1,7-naphthyridine-6-carboxylicacid |
IUPAC Name: | 8-chloro-1,7-naphthyridine-6-carboxylic acid |
Molecular Weight: | 208.6 |
Molecular Formula: | C9H5ClN2O2 |
Canonical SMILES: | C1=CC2=CC(=NC(=C2N=C1)Cl)C(=O)O |
InChI: | InChI=1S/C9H5ClN2O2/c10-8-7-5(2-1-3-11-7)4-6(12-8)9(13)14/h1-4H,(H,13,14) |
InChI Key: | YLISLRCKZWMAIW-UHFFFAOYSA-N |
Complexity: | 237 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.0039551 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.0039551 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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