Home Other Building Blocks 3-(thiophen-2-yl)-1,2,4-oxadiazole-5-thiol

3-(thiophen-2-yl)-1,2,4-oxadiazole-5-thiol

CAS No.:
1340404-47-8
Catalog Number:
AG01AA6S
Molecular Formula:
C6H4N2OS2
Molecular Weight:
184.2388
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Product Description
Catalog Number:
AG01AA6S
Chemical Name:
3-(thiophen-2-yl)-1,2,4-oxadiazole-5-thiol
CAS Number:
1340404-47-8
Molecular Formula:
C6H4N2OS2
Molecular Weight:
184.2388
MDL Number:
MFCD17259803
IUPAC Name:
3-thiophen-2-yl-2H-1,2,4-oxadiazole-5-thione
InChI:
InChI=1S/C6H4N2OS2/c10-6-7-5(8-9-6)4-2-1-3-11-4/h1-3H,(H,7,8,10)
InChI Key:
BTJRHAMOEYRTRE-UHFFFAOYSA-N
SMILES:
Sc1onc(n1)c1cccs1
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.977g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.231g/mol
Monoisotopic Mass:
183.977g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
94A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties