| CAS Number | 1051919-33-5 |
| Catalog Number | AG0090SL(AGN-PC-0WBU9M) |
| Chemical Name | 2-(2-Chloro-4-fluorophenoxy)ethylamine hydrochloride |
| IUPAC Name | 2-(2-chloro-4-fluorophenoxy)ethanamine;hydrochloride |
| InChI | InChI=1S/C8H9ClFNO.ClH/c9-7-5-6(10)1-2-8(7)12-4-3-11;/h1-2,5H,3-4,11H2;1H |
| InChI Key | KNCOTHOJVWILSN-UHFFFAOYSA-N |
| MDL Number | MFCD08728063 |
| Molecular Formula | C8H10Cl2FNO |
| Molecular Weight | 226.0755 |
| SMILES | FC1=CC(Cl)=C(OCCN)C=C1.[H]Cl |
| Synonyms | 2-(2-Chloro-4-fluorophenoxy)ethylamine hydrochloride,
1051919-33-5,
2-(2-Chloro-4-fluorophenoxy)ethanamine hydrochloride,
[2-(2-chloro-4-fluorophenoxy)ethyl]amine hydrochloride,
ARONIS013929,
CTK7E9145,
ALBB-031740,
KS-000044HI,
8151AC,
MFCD08728063,
AKOS005111329,
BB0290836,
TR-042974,
ST45050634,
2-(2-chloro-4-fluorophenoxy)ethylamine, chloride,
2-(2-Chloro-4-fluorophenoxy)ethylaminehydrochloride,
1-(2-aminoethoxy)-2-chloro-4-fluorobenzene hydrochloride,
2-(2-Chloro-4-fluorophenoxy)ethylamine hydrochloride, AldrichCPR,
C8H10Cl2FNO,
|
| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.012g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.072g/mol |
| Monoisotopic Mass | 225.012g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number