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885279-05-0

885279-05-0 structural image
Product Name: 2-(3,4-DIMETHYL-PHENYL)-THIAZOLE-4-CARBALDEHYDE
Formula: C12H11NOS
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COMPUTED DESCRIPTORS

Molecular Weight 217.29 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 217.05613515 g/mol
Monoisotopic Mass 217.05613515 g/mol
Topological Polar Surface Area 58.2 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 234
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