Home Halogens 5-chloro-3-(3-fluoro-5-methoxyphenyl)-1,2,4-oxadiazole

5-chloro-3-(3-fluoro-5-methoxyphenyl)-1,2,4-oxadiazole

CAS No.:
1934801-60-1
Catalog Number:
AG01BUMT
Molecular Formula:
C9H6ClFN2O2
Molecular Weight:
228.6075
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Product Description
Catalog Number:
AG01BUMT
Chemical Name:
5-chloro-3-(3-fluoro-5-methoxyphenyl)-1,2,4-oxadiazole
CAS Number:
1934801-60-1
Molecular Formula:
C9H6ClFN2O2
Molecular Weight:
228.6075
IUPAC Name:
5-chloro-3-(3-fluoro-5-methoxyphenyl)-1,2,4-oxadiazole
InChI:
InChI=1S/C9H6ClFN2O2/c1-14-7-3-5(2-6(11)4-7)8-12-9(10)15-13-8/h2-4H,1H3
InChI Key:
GFZFKCKGLSAAEF-UHFFFAOYSA-N
SMILES:
COc1cc(F)cc(c1)c1noc(n1)Cl
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.01g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.607g/mol
Monoisotopic Mass:
228.01g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
48.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties