5-Hydroxy-3-(3-pyridyl)isoxazole - CAS 1354939-73-3
Catalog: |
BB008196 |
Product Name: |
5-Hydroxy-3-(3-pyridyl)isoxazole |
CAS: |
1354939-73-3 |
Synonyms: |
3-(3-pyridinyl)-2H-isoxazol-5-one; 3-pyridin-3-yl-2H-1,2-oxazol-5-one |
IUPAC Name: | 3-pyridin-3-yl-2H-1,2-oxazol-5-one |
Description: | 5-Hydroxy-3-(3-pyridyl)isoxazole (CAS# 1354939-73-3 ) is a useful research chemical. |
Molecular Weight: | 162.15 |
Molecular Formula: | C8H6N2O2 |
Canonical SMILES: | C1=CC(=CN=C1)C2=CC(=O)ON2 |
InChI: | InChI=1S/C8H6N2O2/c11-8-4-7(10-12-8)6-2-1-3-9-5-6/h1-5,10H |
InChI Key: | ZNACOKOVLHIQSC-UHFFFAOYSA-N |
LogP: | 1.44220 |
Publication Number | Title | Priority Date |
CA-2097766-A1 | Pyridyl-1,2,5-oxadiazolecarboxamide-2-oxides | 19920605 |
DE-4218582-A1 | Pyridyl-1,2,5-oxadiazole-carbonamide-2-oxides | 19920605 |
EP-0575754-A1 | Pyridyl-1,2,5-oxadiazol-2-oxide-carbonamides for the treatment of NO-dependent disfunctions like angina pectoris and erection disorders | 19920605 |
US-5374640-A | Pyridyl-1,2,5-oxadiazolecarboxamide-2-oxides | 19920605 |
Complexity: | 225 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.042927438 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.042927438 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 51.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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