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676996-35-3

676996-35-3 structural image
Product Name: 3-(2-ACETYL-5-TERT-BUTYL-THIOPHEN-3-YLCARBAMOYL)-ACRYLIC ACID
Formula: C14H17NO4S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 40 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 295.36 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 295.08782920 g/mol
Monoisotopic Mass 295.08782920 g/mol
Topological Polar Surface Area 112 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 439
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