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138716-27-5

138716-27-5 structural image
Product Name: (E)-3-(DIMETHYLAMINO)-1-(3-METHYL-2-THIENYL)-2-PROPEN-1-ONE
Formula: C10H13NOS
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >29.3 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 195.28 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 195.07178521 g/mol
Monoisotopic Mass 195.07178521 g/mol
Topological Polar Surface Area 48.6 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 213
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes