| CAS Number | 951915-17-6 |
| Catalog Number | AG01A4VM |
| Chemical Name | 2-(4-Bromo-2,6-dichlorophenoxy)ethan-1-amine |
| IUPAC Name | 2-(4-bromo-2,6-dichlorophenoxy)ethanamine |
| InChI | InChI=1S/C8H8BrCl2NO/c9-5-3-6(10)8(7(11)4-5)13-2-1-12/h3-4H,1-2,12H2 |
| InChI Key | USOXOAGZHSJAGB-UHFFFAOYSA-N |
| MDL Number | MFCD09906786 |
| Molecular Formula | C8H8BrCl2NO |
| Molecular Weight | 284.9652 |
| SMILES | NCCOC1=C(Cl)C=C(Br)C=C1Cl |
| Synonyms | 2-(2-aminoethoxy)-5-bromo-1,3-dichlorobenzene,
951915-17-6,
2-(4-bromo-2,6-dichlorophenoxy)ethan-1-amine,
ZINC11946021,
NE24376,
A1-12937,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 282.917g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 284.962g/mol |
| Monoisotopic Mass | 282.917g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number