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

5-(3,5-Dimethoxyphenyl)-1,3,4-oxadiazole-2-thiol

CAS No.:
749902-08-7
Catalog Number:
AG019JLP
Molecular Formula:
C10H10N2O3S
Molecular Weight:
238.2630
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019JLP
Chemical Name:
5-(3,5-Dimethoxyphenyl)-1,3,4-oxadiazole-2-thiol
CAS Number:
749902-08-7
Molecular Formula:
C10H10N2O3S
Molecular Weight:
238.2630
MDL Number:
MFCD06335748
IUPAC Name:
5-(3,5-dimethoxyphenyl)-3H-1,3,4-oxadiazole-2-thione
InChI:
InChI=1S/C10H10N2O3S/c1-13-7-3-6(4-8(5-7)14-2)9-11-12-10(16)15-9/h3-5H,1-2H3,(H,12,16)
InChI Key:
RETOHBVQLQTXEU-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1)OC)c1nnc(o1)S
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.041g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.261g/mol
Monoisotopic Mass:
238.041g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties