914203-00-2
Product Name:
1H-INDOLE-1,3-DICARBOXYLIC ACID, 4-BROMO-, 1-(1,1-DIMETHYLETHYL)ESTER
Formula:
C14H14BrNO4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 340.17 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 339.01062 g/mol |
| Monoisotopic Mass | 339.01062 g/mol |
| Topological Polar Surface Area | 68.5 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 407 |
| 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 |