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675198-91-1 | 3(2H)-Isoxazolone, 5-hydroxy-
CAS No: 675198-91-1 Catalog No: AG005MYB MDL No:
Product Description
Catalog Number:
AG005MYB
Chemical Name:
3(2H)-Isoxazolone, 5-hydroxy-
CAS Number:
675198-91-1
Molecular Formula:
C3H3NO3
Molecular Weight:
101.0608
IUPAC Name:
5-hydroxy-1,2-oxazol-3-one
InChI:
InChI=1S/C3H3NO3/c5-2-1-3(6)7-4-2/h1,6H,(H,4,5)
InChI Key:
PNICOKLUBCGUPE-UHFFFAOYSA-N
SMILES:
Oc1cc(=O)[nH]o1
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
101.011g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
101.061g/mol
Monoisotopic Mass:
101.011g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
Literature
| Title | Journal |
|---|---|
| [Design, synthesis and insulin-sensitizing activity of some peroxisome proliferator-activated gamma agonists]. | Yao xue xue bao = Acta pharmaceutica Sinica 20050201 |
| [The chemical structure and pharmacological properties of a novel isoxazolidinedione insulin sensitizer, JTT-501]. | Nihon rinsho. Japanese journal of clinical medicine 20011101 |
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