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5932-30-9

5932-30-9 structural image
Product Name: 5-PHENYL-PYRAZOLE-3-CARBOXYLIC ACID ETHYL ESTER
Formula: C12H12N2O2
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 10.7 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 216.24 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 216.089877630 g/mol
Monoisotopic Mass 216.089877630 g/mol
Topological Polar Surface Area 55 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 239
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