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89088-62-0 | 5H-Pyrazolo[3,4-d]-1,2,3-thiadiazole, 5-methyl-
CAS No: 89088-62-0 Catalog No: AG003Z1X MDL No:
Product Description
Catalog Number:
AG003Z1X
Chemical Name:
5H-Pyrazolo[3,4-d]-1,2,3-thiadiazole, 5-methyl-
CAS Number:
89088-62-0
Molecular Formula:
C4H4N4S
Molecular Weight:
140.1664
IUPAC Name:
5-methylpyrazolo[3,4-d]thiadiazole
InChI:
InChI=1S/C4H4N4S/c1-8-2-3-4(6-8)5-7-9-3/h2H,1H3
InChI Key:
CWTPUBZHCJFHPI-UHFFFAOYSA-N
SMILES:
Cn1nc2c(c1)snn2
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.016g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.164g/mol
Monoisotopic Mass:
140.016g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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