Home Halogens 3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole

3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole

CAS No.:
1208-05-5
Catalog Number:
AG01AFSM
Molecular Formula:
C9H5Cl3N2O
Molecular Weight:
263.5078
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Product Description
Catalog Number:
AG01AFSM
Chemical Name:
3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole
CAS Number:
1208-05-5
Molecular Formula:
C9H5Cl3N2O
Molecular Weight:
263.5078
MDL Number:
MFCD01710588
IUPAC Name:
3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole
InChI:
InChI=1S/C9H5Cl3N2O/c10-9(11,12)8-13-7(14-15-8)6-4-2-1-3-5-6/h1-5H
InChI Key:
DYLKAZGGQBPFEM-UHFFFAOYSA-N
SMILES:
ClC(c1onc(n1)c1ccccc1)(Cl)Cl
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.947g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.502g/mol
Monoisotopic Mass:
261.947g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties