| CAS Number | 1333642-90-2 |
| Catalog Number | AG01AKEJ |
| Chemical Name | 2-amino-1-(2,6-difluorophenyl)ethan-1-ol hydrochloride |
| IUPAC Name | 2-amino-1-(2,6-difluorophenyl)ethanol;hydrochloride |
| InChI | InChI=1S/C8H9F2NO.ClH/c9-5-2-1-3-6(10)8(5)7(12)4-11;/h1-3,7,12H,4,11H2;1H |
| InChI Key | LVDXAOPWUUSATR-UHFFFAOYSA-N |
| MDL Number | MFCD09831936 |
| Molecular Formula | C8H10ClF2NO |
| Molecular Weight | 209.6209 |
| SMILES | Cl.NCC(C1=C(F)C=CC=C1F)O |
| Synonyms | 2-amino-1-(2,6-difluorophenyl)ethan-1-ol hydrochloride,
1333642-90-2,
2-AMINO-1-(2,6-DIFLUOROPHENYL)ETHANOL HYDROCHLORIDE,
MCULE-1833430595,
NE43986,
EN300-83876,
700A341,
2-Amino-1-(2,6-difluoro-phenyl)-ethanol hydrochloride,
Z1255524191,
133562-32-0,
|
| Complexity | 135 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.042g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.621g/mol |
| Monoisotopic Mass | 209.042g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number