| CAS Number | 874285-32-2 |
| Catalog Number | AG01AI48(AGN-PC-0A9YQA) |
| Chemical Name | 2-(2-chloro-4-fluorophenyl)ethan-1-amine hydrochloride |
| IUPAC Name | 2-(2-chloro-4-fluorophenyl)ethanamine;hydrochloride |
| InChI | InChI=1S/C8H9ClFN.ClH/c9-8-5-7(10)2-1-6(8)3-4-11;/h1-2,5H,3-4,11H2;1H |
| InChI Key | DCNISAIPBAVUSA-UHFFFAOYSA-N |
| MDL Number | MFCD18838829 |
| Molecular Formula | C8H10Cl2FN |
| Molecular Weight | 210.0761 |
| SMILES | Cl.NCCC1=C(Cl)C=C(F)C=C1 |
| Synonyms | 2-(2-chloro-4-fluorophenyl)ethan-1-amine hydrochloride,
874285-32-2,
SCHEMBL2211929,
MCULE-3824038796,
NE36649,
EN300-76702,
Z1267881686,
|
| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.017g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.073g/mol |
| Monoisotopic Mass | 209.017g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number