13024-90-3
Product Name:
1-(4-Chlorophenyl)-3-methyl-2-pyrazolin-5-one
Formula:
C10H9ClN2O
Synonyms:
1-(4-Chlorophenyl)-3-methyl-5-pyrazolone;2-(4-Chlorophenyl)-2,4-dihydro-5-methyl-3H-pyrazol-3-one;3-Methyl-1-(4-chlorophenyl)-5-pyrazolone
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CHEMICAL AND PHYSICAL PROPERTIES
Solubility | 26 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 208.64 g/mol |
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XLogP3 | 1.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 1 |
Exact Mass | 208.0403406 g/mol |
Monoisotopic Mass | 208.0403406 g/mol |
Topological Polar Surface Area | 32.7 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 269 |
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 |