351984-79-7
Product Name:
Benzoic acid, 3-[(1-oxopropyl)amino]-, methyl ester (9CI)
Formula:
C11H13NO3
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | 29.4 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 207.23 g/mol |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 207.08954328 g/mol |
| Monoisotopic Mass | 207.08954328 g/mol |
| Topological Polar Surface Area | 55.4 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 240 |
| 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 |