| CAS Number | 1258639-91-6 |
| Catalog Number | AG01AB8R |
| Chemical Name | 4-(2-AMINOETHOXY)-1,2-DIFLUOROBENZENE HYDROCHLORIDE |
| IUPAC Name | 2-(3,4-difluorophenoxy)ethanamine;hydrochloride |
| InChI | InChI=1S/C8H9F2NO.ClH/c9-7-2-1-6(5-8(7)10)12-4-3-11;/h1-2,5H,3-4,11H2;1H |
| InChI Key | JHKQKOYAVFSDAO-UHFFFAOYSA-N |
| MDL Number | MFCD17977118 |
| Molecular Formula | C8H10ClF2NO |
| Molecular Weight | 209.6209 |
| SMILES | FC1=CC=C(OCCN)C=C1F.[H]Cl |
| Synonyms | 4-(2-aminoethoxy)-1,2-difluorobenzene hydrochloride,
1258639-91-6,
2-(3,4-difluorophenoxy)ethan-1-amine hydrochloride,
AC1Q3DEJ,
AKOS008135294,
MCULE-1817816848,
NE16244,
EN300-70799,
Z1263820280,
|
| Complexity | 134 |
| 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