Home Carboxys thieno[2,3-d][1,2,3]thiadiazole-6-carboxylic acid

thieno[2,3-d][1,2,3]thiadiazole-6-carboxylic acid

CAS No.:
192878-30-1
Catalog Number:
AG01EK7D
Molecular Formula:
C5H2N2O2S2
Molecular Weight:
186.2116
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Product Description
Catalog Number:
AG01EK7D
Chemical Name:
thieno[2,3-d][1,2,3]thiadiazole-6-carboxylic acid
CAS Number:
192878-30-1
Molecular Formula:
C5H2N2O2S2
Molecular Weight:
186.2116
MDL Number:
MFCD05256444
IUPAC Name:
thieno[2,3-d]thiadiazole-6-carboxylic acid
InChI:
InChI=1S/C5H2N2O2S2/c8-5(9)2-1-10-4-3(2)11-7-6-4/h1H,(H,8,9)
InChI Key:
FDZNFTUGBZLIHN-UHFFFAOYSA-N
SMILES:
OC(=O)c1csc2c1snn2
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.956g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.203g/mol
Monoisotopic Mass:
185.956g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties