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Home > Pyridines > 929973-63-7
929973-63-7 | 5,6,7-trimethyl-6H-pyrrolo[3,4-d]pyridazine-1-thiol
CAS No: 929973-63-7 Catalog No: AG019KKO MDL No:MFCD09040579
Product Description
Catalog Number:
AG019KKO
Chemical Name:
5,6,7-trimethyl-6H-pyrrolo[3,4-d]pyridazine-1-thiol
CAS Number:
929973-63-7
Molecular Formula:
C9H11N3S
Molecular Weight:
193.2687
MDL Number:
MFCD09040579
IUPAC Name:
5,6,7-trimethyl-2H-pyrrolo[3,4-d]pyridazine-1-thione
InChI:
InChI=1S/C9H11N3S/c1-5-7-4-10-11-9(13)8(7)6(2)12(5)3/h4H,1-3H3,(H,11,13)
InChI Key:
WTAGVWQSFFPINR-UHFFFAOYSA-N
SMILES:
Cn1c(C)c2c(c1C)c(S)nnc2
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.268g/mol
Monoisotopic Mass:
193.067g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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