550312-50-0
Product Name:
Butanoic acid, 4-[(3-ethylphenyl)amino]-4-oxo- (9CI)
Formula:
C12H15NO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 221.25 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 221.10519334 g/mol |
| Monoisotopic Mass | 221.10519334 g/mol |
| Topological Polar Surface Area | 66.4 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 253 |
| 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 |