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79559-08-3

79559-08-3 structural image
Product Name: methyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)acetate
Formula: C8H12N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 168.19 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 168.089877630 g/mol
Monoisotopic Mass 168.089877630 g/mol
Topological Polar Surface Area 44.1 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 172
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