2-Amino-5-fluoronicotinic acid - CAS 1196154-03-6
Catalog: |
BB004548 |
Product Name: |
2-Amino-5-fluoronicotinic acid |
CAS: |
1196154-03-6 |
Synonyms: |
2-amino-5-fluoropyridine-3-carboxylic acid |
IUPAC Name: | 2-amino-5-fluoropyridine-3-carboxylic acid |
Description: | 2-Amino-5-fluoronicotinic Acid acts as a reagent used in the synthesis of fluoropiperidine derivatives as orexin receptor antagonists. |
Molecular Weight: | 156.11 |
Molecular Formula: | C6H5FN2O2 |
Canonical SMILES: | C1=C(C(=NC=C1F)N)C(=O)O |
InChI: | InChI=1S/C6H5FN2O2/c7-3-1-4(6(10)11)5(8)9-2-3/h1-2H,(H2,8,9)(H,10,11) |
InChI Key: | LLLGMKGDTWQLRK-UHFFFAOYSA-N |
Appearance: | Solid |
Storage: | Keep in dark place, Inert atmosphere, Room temperature |
LogP: | 1.08230 |
Publication Number | Title | Priority Date |
AU-2016317806-A1 | Heteroaryl compounds and their use as therapeutic drugs | 20150831 |
CA-2995675-A1 | Heteroaryl compounds and their use as therapeutic drugs | 20150831 |
EP-3344613-A1 | Heteroaryl compounds and their use as therapeutic drugs | 20150831 |
EP-3344613-B1 | Heteroaryl compounds and their use as therapeutic drugs | 20150831 |
KR-20180044995-A | Heteroaryl compounds and uses thereof as therapeutic agents | 20150831 |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 156.03350557 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 156.03350557 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 76.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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