855991-71-8
Product Name:
9-CHLORO-3,4-DIHYDRO-2H-1,5-BENZODIOXEPINE-7-CARBOXYLIC ACID
Formula:
C10H9ClO4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 228.63 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 228.0189365 g/mol |
| Monoisotopic Mass | 228.0189365 g/mol |
| Topological Polar Surface Area | 55.8 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 246 |
| 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 |