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837396-23-3 | Pyridazine, 3-chloro-6-[4-(ethylsulfonyl)phenyl]-
CAS No: 837396-23-3 Catalog No: AG0055XX MDL No:
Product Description
Catalog Number:
AG0055XX
Chemical Name:
Pyridazine, 3-chloro-6-[4-(ethylsulfonyl)phenyl]-
CAS Number:
837396-23-3
Molecular Formula:
C12H11ClN2O2S
Molecular Weight:
282.7459
IUPAC Name:
3-chloro-6-(4-ethylsulfonylphenyl)pyridazine
InChI:
InChI=1S/C12H11ClN2O2S/c1-2-18(16,17)10-5-3-9(4-6-10)11-7-8-12(13)15-14-11/h3-8H,2H2,1H3
InChI Key:
UIPQMUPUDXNIPZ-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)c1ccc(cc1)c1ccc(nn1)Cl
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.023g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.742g/mol
Monoisotopic Mass:
282.023g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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