425609-97-8
Product Name:
3-(4-METHOXY-PHENYL)-ISOXAZOLE-5-CARBOXYLIC ACID METHYL ESTER
Formula:
C12H11NO4
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | 9.7 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 233.22 g/mol |
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XLogP3 | 2.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 4 |
Exact Mass | 233.06880783 g/mol |
Monoisotopic Mass | 233.06880783 g/mol |
Topological Polar Surface Area | 61.6 Ų |
Heavy Atom Count | 17 |
Formal Charge | 0 |
Complexity | 263 |
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 |