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Home > Imidazoles > 110714-14-2
110714-14-2 | 6-(1H-imidazol-1-yl)pyridazin-3-ol
CAS No: 110714-14-2 Catalog No: AG018BNZ MDL No:MFCD15194901
Product Description
Catalog Number:
AG018BNZ
Chemical Name:
6-(1H-imidazol-1-yl)pyridazin-3-ol
CAS Number:
110714-14-2
Molecular Formula:
C7H6N4O
Molecular Weight:
162.1487
MDL Number:
MFCD15194901
IUPAC Name:
3-imidazol-1-yl-1H-pyridazin-6-one
InChI:
InChI=1S/C7H6N4O/c12-7-2-1-6(9-10-7)11-4-3-8-5-11/h1-5H,(H,10,12)
InChI Key:
RQOGBYHTYBWDIW-UHFFFAOYSA-N
SMILES:
Oc1ccc(nn1)n1cncc1
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.054g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
162.152g/mol
Monoisotopic Mass:
162.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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