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684228-34-0

684228-34-0 structural image
Product Name: 1-(5-(furan-2-yl)-3-(p-tolyl)-4,5-dihydro-1H-pyrazol-1-yl)propan-1-one
Formula: C17H18N2O2
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 5.3 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 282.34 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 282.136827821 g/mol
Monoisotopic Mass 282.136827821 g/mol
Topological Polar Surface Area 45.8 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 413
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes