5-Hydroxy-3-(2-methoxyphenyl)isoxazole - CAS 1354915-50-6
Catalog: |
BB008185 |
Product Name: |
5-Hydroxy-3-(2-methoxyphenyl)isoxazole |
CAS: |
1354915-50-6 |
Synonyms: |
3-(2-methoxyphenyl)-2H-isoxazol-5-one; 3-(2-methoxyphenyl)-2H-1,2-oxazol-5-one |
IUPAC Name: | 3-(2-methoxyphenyl)-2H-1,2-oxazol-5-one |
Description: | 5-Hydroxy-3-(2-methoxyphenyl)isoxazole (CAS# 1354915-50-6 ) is a useful research chemical. |
Molecular Weight: | 191.18 |
Molecular Formula: | C10H9NO3 |
Canonical SMILES: | COC1=CC=CC=C1C2=CC(=O)ON2 |
InChI: | InChI=1S/C10H9NO3/c1-13-9-5-3-2-4-7(9)8-6-10(12)14-11-8/h2-6,11H,1H3 |
InChI Key: | WIBVABFPOYOXQR-UHFFFAOYSA-N |
LogP: | 2.05580 |
Publication Number | Title | Priority Date |
US-2012065063-A1 | 3-Aryl-4-(2,6-dimethylbenzylidene)isoxazol-5(4H)-ones as Fungicides | 20100622 |
WO-2011161034-A1 | 3-aryl-4-(2,6-dimethylbenzylidene)-isoxazol-5(4h)-ones as fungicides | 20100622 |
Complexity: | 262 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 191.058243149 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 191.058243149 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 47.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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