88-76-6
Product Name:
4-Chloro-3-(3-methyl-5-oxo-2-pyrazolin-1-yl)benzenesulfonic acid
Formula:
C10H9ClN2O4S
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COMPUTED DESCRIPTORS
Molecular Weight | 288.71 g/mol |
---|---|
XLogP3 | 0.6 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 2 |
Exact Mass | 287.9971556 g/mol |
Monoisotopic Mass | 287.9971556 g/mol |
Topological Polar Surface Area | 95.4 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 485 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
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