709004-41-1
Product Name:
1H-INDOLE-3-CARBOXYLIC ACID, 1-[(4-BROMOPHENYL)METHYL]-, METHYL ESTER
Formula:
C17H14BrNO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 344.2 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 343.02079 g/mol |
| Monoisotopic Mass | 343.02079 g/mol |
| Topological Polar Surface Area | 31.2 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 368 |
| 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 |