1,3,4-Oxadiazole-2(3H)-thione, 5-(4-chlorophenyl)-


Chemical Name: 1,3,4-Oxadiazole-2(3H)-thione, 5-(4-chlorophenyl)-
CAS Number: 23766-28-1
Product Number: AG003M5K(AGN-PC-0JVOG0)
Synonyms:
MDL No:
Molecular Formula: C8H5ClN2OS
Molecular Weight: 212.6561

Identification/Properties


Properties
MP:
171-175℃
BP:
277°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
212.651g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
211.981g/mol
Monoisotopic Mass:
211.981g/mol
Topological Polar Surface Area:
65.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
249
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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