| CAS Number | 1423040-76-9 |
| Catalog Number | AG01A3JX |
| Chemical Name | (1S)-1-(5-Chloro-2-fluorophenyl)ethan-1-amine hydrochloride |
| IUPAC Name | (1S)-1-(5-chloro-2-fluorophenyl)ethanamine;hydrochloride |
| InChI | InChI=1S/C8H9ClFN.ClH/c1-5(11)7-4-6(9)2-3-8(7)10;/h2-5H,11H2,1H3;1H/t5-;/m0./s1 |
| InChI Key | ZJWNGZJNOWRDLV-JEDNCBNOSA-N |
| MDL Number | MFCD22741298 |
| Molecular Formula | C8H10Cl2FN |
| Molecular Weight | 210.0761 |
| SMILES | Cl.ClC=1C=CC(=C(C1)[C@H](C)N)F |
| Synonyms | (1S)-1-(5-chloro-2-fluorophenyl)ethan-1-amine hydrochloride,
1423040-76-9,
SCHEMBL20238264,
NE46047,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| 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 | 1 |
| 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