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Home > Pyridines > 1105195-22-9
1105195-22-9 | 6-(2,4-Dimethyl-1,3-thiazol-5-yl)pyridazin-3-ol
CAS No: 1105195-22-9 Catalog No: AG01AQJ2 MDL No:MFCD18879564
Product Description
Catalog Number:
AG01AQJ2
Chemical Name:
6-(2,4-Dimethyl-1,3-thiazol-5-yl)pyridazin-3-ol
CAS Number:
1105195-22-9
Molecular Formula:
C9H9N3OS
Molecular Weight:
207.2523
MDL Number:
MFCD18879564
IUPAC Name:
3-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-pyridazin-6-one
InChI:
InChI=1S/C9H9N3OS/c1-5-9(14-6(2)10-5)7-3-4-8(13)12-11-7/h3-4H,1-2H3,(H,12,13)
InChI Key:
RBVNDYTYCQKYLO-UHFFFAOYSA-N
SMILES:
Oc1ccc(nn1)c1sc(nc1C)C
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.047g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.251g/mol
Monoisotopic Mass:
207.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
82.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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