| CAS Number | 1203684-62-1 |
| Catalog Number | AG01C4MF |
| Chemical Name | 6,8-Difluoro-1,2,3,4-tetrahydroisoquinoline hydrochloride |
| IUPAC Name | 6,8-difluoro-1,2,3,4-tetrahydroisoquinoline;hydrochloride |
| InChI | InChI=1S/C9H9F2N.ClH/c10-7-3-6-1-2-12-5-8(6)9(11)4-7;/h3-4,12H,1-2,5H2;1H |
| InChI Key | IYUAFSWSWUNKFB-UHFFFAOYSA-N |
| MDL Number | MFCD08752235 |
| Molecular Formula | C9H10ClF2N |
| Molecular Weight | 205.6322 |
| SMILES | FC1=CC(F)=CC2=C1CNCC2.[H]Cl |
| Synonyms | 6,8-difluoro-1,2,3,4-tetrahydroisoquinoline hydrochloride,
1203684-62-1,
AKOS032945581,
|
| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.633g/mol |
| Monoisotopic Mass | 205.047g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number