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21474-06-6 | 4-Isoxazolol,3-phenyl-(8CI,9CI)
CAS No: 21474-06-6 Catalog No: AG00BUY2 MDL No:
Product Description
Catalog Number:
AG00BUY2
Chemical Name:
4-Isoxazolol,3-phenyl-(8CI,9CI)
CAS Number:
21474-06-6
IUPAC Name:
3-phenyl-1,2-oxazol-4-ol
InChI:
InChI=1S/C9H7NO2/c11-8-6-12-10-9(8)7-4-2-1-3-5-7/h1-6,11H
InChI Key:
CHVYBAMNVKEFGF-UHFFFAOYSA-N
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.048g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.16g/mol
Monoisotopic Mass:
161.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Biaryl isoxazolinone antibacterial agents. | Bioorganic & medicinal chemistry letters 20050602 |
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