344276-77-3
Product Name:
3-[3-(4-METHYLPHENYL)-2,1-BENZISOXAZOL-5-YL]ACRYLIC ACID
Formula:
C17H13NO3
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COMPUTED DESCRIPTORS
Molecular Weight | 279.29 g/mol |
---|---|
XLogP3 | 3.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 279.08954328 g/mol |
Monoisotopic Mass | 279.08954328 g/mol |
Topological Polar Surface Area | 63.3 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 401 |
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 |