| CAS Number | 860437-59-8 |
| Catalog Number | AG01BXGH(AGN-PC-0OK4YG) |
| Chemical Name | 1,2,3,4-Tetrahydroisoquinolin-5-Ol Hydrobromide |
| IUPAC Name | 1,2,3,4-tetrahydroisoquinolin-5-ol;hydrobromide |
| InChI | InChI=1S/C9H11NO.BrH/c11-9-3-1-2-7-6-10-5-4-8(7)9;/h1-3,10-11H,4-6H2;1H |
| InChI Key | DJRVVUYFODXFSR-UHFFFAOYSA-N |
| MDL Number | MFCD29067784 |
| Molecular Formula | C9H12BrNO |
| Molecular Weight | 230.1017 |
| SMILES | OC1C2CCNCC=2C=CC=1.[H]Br |
| Synonyms | 1,2,3,4-Tetrahydroisoquinolin-5-ol hydrobromide,
860437-59-8,
AX8276590,
Z2689172101,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.105g/mol |
| Monoisotopic Mass | 229.01g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number