| CAS Number | 2794-41-4 |
| Catalog Number | AG01AAY7 |
| Chemical Name | 1-(4-fluorophenyl)-2-(methylamino)ethan-1-ol hydrochloride |
| IUPAC Name | 1-(4-fluorophenyl)-2-(methylamino)ethanol;hydrochloride |
| InChI | InChI=1S/C9H12FNO.ClH/c1-11-6-9(12)7-2-4-8(10)5-3-7;/h2-5,9,11-12H,6H2,1H3;1H |
| InChI Key | WVOCBIBUULBZSN-UHFFFAOYSA-N |
| MDL Number | MFCD17480468 |
| Molecular Formula | C9H13ClFNO |
| Molecular Weight | 205.6570 |
| SMILES | Cl.CNCC(C1=CC=C(F)C=C1)O |
| Synonyms | 1-(4-fluorophenyl)-2-(methylamino)ethan-1-ol hydrochloride,
2794-41-4,
AC1Q3BS0,
MCULE-8803826161,
NE50174,
EN300-69900,
Z1263820285,
|
| Complexity | 124 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.657g/mol |
| Monoisotopic Mass | 205.067g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number