228728-16-3
Product Name:
2-BOC-7-IODO-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID
Formula:
C15H18INO4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 403.21 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 403.02806 g/mol |
| Monoisotopic Mass | 403.02806 g/mol |
| Topological Polar Surface Area | 66.8 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 420 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |