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956786-73-5

956786-73-5 structural image
Product Name: 1-(4-BUTYL-PHENYL)-5-(4-CHLORO-PHENYL)-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
Formula: C21H21ClN2O2
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COMPUTED DESCRIPTORS

Molecular Weight 368.9 g/mol
XLogP3 6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 6
Exact Mass 368.1291556 g/mol
Monoisotopic Mass 368.1291556 g/mol
Topological Polar Surface Area 55.1 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 459
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