63123-17-1
Product Name:
2-[2,4-Bis(1,1-dimethylpropyl)phenoxy]-5-nitrobenzoic acid
Formula:
C23H29NO5
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 399.5 g/mol |
|---|---|
| XLogP3 | 7.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 399.20457303 g/mol |
| Monoisotopic Mass | 399.20457303 g/mol |
| Topological Polar Surface Area | 92.4 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 582 |
| 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 |