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876316-61-9

876316-61-9 structural image
Product Name: 3-(CHLOROMETHYL)-1-METHYL-5-THIEN-2-YL-1H-PYRAZOLE
Formula: C9H9ClN2S
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COMPUTED DESCRIPTORS

Molecular Weight 212.70 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 212.0174972 g/mol
Monoisotopic Mass 212.0174972 g/mol
Topological Polar Surface Area 46.1 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 179
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