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155164-61-7 | 3(2H)-Pyridazinone, 4,5-dichloro-2-[(4-nitrophenyl)sulfonyl]-
CAS No: 155164-61-7 Catalog No: AG001NOA MDL No:
Product Description
Catalog Number:
AG001NOA
Chemical Name:
3(2H)-Pyridazinone, 4,5-dichloro-2-[(4-nitrophenyl)sulfonyl]-
CAS Number:
155164-61-7
Molecular Formula:
C10H5Cl2N3O5S
Molecular Weight:
350.1348
IUPAC Name:
4,5-dichloro-2-(4-nitrophenyl)sulfonylpyridazin-3-one
InChI:
InChI=1S/C10H5Cl2N3O5S/c11-8-5-13-14(10(16)9(8)12)21(19,20)7-3-1-6(2-4-7)15(17)18/h1-5H
InChI Key:
CWQMZMPHMWBCFH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)n1ncc(c(c1=O)Cl)Cl
Properties
Complexity:
626
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.933g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
350.126g/mol
Monoisotopic Mass:
348.933g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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