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697-72-3 | 6H,7H-thieno[2,3-d]pyridazin-7-one
CAS No: 697-72-3 Catalog No: AG01EILX MDL No:MFCD30290616
Product Description
Catalog Number:
AG01EILX
Chemical Name:
6H,7H-thieno[2,3-d]pyridazin-7-one
CAS Number:
697-72-3
Molecular Formula:
C6H4N2OS
Molecular Weight:
152.1738
MDL Number:
MFCD30290616
IUPAC Name:
6H-thieno[2,3-d]pyridazin-7-one
InChI:
InChI=1S/C6H4N2OS/c9-6-5-4(1-2-10-5)3-7-8-6/h1-3H,(H,8,9)
InChI Key:
AKSHAFWAEINGQL-UHFFFAOYSA-N
SMILES:
O=c1[nH]ncc2c1scc2
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.004g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
152.171g/mol
Monoisotopic Mass:
152.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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