3-(2,4-Dichlorophenyl)-5-hydroxyisoxazole - CAS 1354923-61-7
Catalog: |
BB008187 |
Product Name: |
3-(2,4-Dichlorophenyl)-5-hydroxyisoxazole |
CAS: |
1354923-61-7 |
Synonyms: |
3-(2,4-dichlorophenyl)-2H-isoxazol-5-one; 3-(2,4-dichlorophenyl)-2H-1,2-oxazol-5-one |
IUPAC Name: | 3-(2,4-dichlorophenyl)-2H-1,2-oxazol-5-one |
Description: | 3-(2,4-Dichlorophenyl)-5-hydroxyisoxazole (CAS# 1354923-61-7 ) is a useful research chemical. |
Molecular Weight: | 230.05 |
Molecular Formula: | C9H5Cl2NO2 |
Canonical SMILES: | C1=CC(=C(C=C1Cl)Cl)C2=CC(=O)ON2 |
InChI: | InChI=1S/C9H5Cl2NO2/c10-5-1-2-6(7(11)3-5)8-4-9(13)14-12-8/h1-4,12H |
InChI Key: | GCINICIBCAVPPG-UHFFFAOYSA-N |
LogP: | 3.35400 |
Publication Number | Title | Priority Date |
US-2012100989-A1 | 3-Aryl-4-(2-thienylmethylene)isoxazol-5(4H)-ones as Fungicides | 20100622 |
WO-2011161035-A1 | 3-aryl-4-(2-thienylmethylene)-isoxazol-5(4h)-ones as fungicides | 20100622 |
Complexity: | 280 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.9697338 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.9697338 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 38.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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