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19111-68-3 | Thieno[2,3-d]pyridazine-7(6H)-thione
CAS No: 19111-68-3 Catalog No: AG002F2D MDL No:
Product Description
Catalog Number:
AG002F2D
Chemical Name:
Thieno[2,3-d]pyridazine-7(6H)-thione
CAS Number:
19111-68-3
Molecular Formula:
C6H4N2S2
Molecular Weight:
168.2394
IUPAC Name:
6H-thieno[2,3-d]pyridazine-7-thione
InChI:
InChI=1S/C6H4N2S2/c9-6-5-4(1-2-10-5)3-7-8-6/h1-3H,(H,8,9)
InChI Key:
RCGMJFIJVKTRAI-UHFFFAOYSA-N
SMILES:
S=c1[nH]ncc2c1scc2
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.982g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.232g/mol
Monoisotopic Mass:
167.982g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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