111599-06-5
Product Name:
(7-HYDROXY-6-METHOXY-1,2,3,4-TETRAHYDRO-ISOQUINOLIN-1-YL)-ACETIC ACID
Formula:
C12H15NO4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 237.25 g/mol |
|---|---|
| XLogP3 | -1.8 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 237.10010796 g/mol |
| Monoisotopic Mass | 237.10010796 g/mol |
| Topological Polar Surface Area | 78.8 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 284 |
| 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 |