| CAS Number | 914086-52-5 |
| Catalog Number | AG01ASTA |
| Chemical Name | 2-(3,5-Difluorophenoxy)ethan-1-amine hydrochloride |
| IUPAC Name | 2-(3,5-difluorophenoxy)ethanamine;hydrochloride |
| InChI | InChI=1S/C8H9F2NO.ClH/c9-6-3-7(10)5-8(4-6)12-2-1-11;/h3-5H,1-2,11H2;1H |
| InChI Key | UXFBRXQUBAAQJO-UHFFFAOYSA-N |
| MDL Number | MFCD28125969 |
| Molecular Formula | C8H10ClF2NO |
| Molecular Weight | 209.6209 |
| SMILES | Cl.FC=1C=C(OCCN)C=C(C1)F |
| Synonyms | 2-(3,5-difluorophenoxy)ethan-1-amine hydrochloride,
914086-52-5,
SCHEMBL1290769,
UXFBRXQUBAAQJO-UHFFFAOYSA-N,
AKOS026747143,
2-(3,5-difluorophenoxy)ethylamine hydrochloride,
F2167-1445,
2-(3,5-difluorophenoxy)ethanamine;hydrochloride,
|
| Complexity | 124 |
| 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 | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.621g/mol |
| Monoisotopic Mass | 209.042g/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