| CAS Number | 1400644-28-1 |
| Catalog Number | AG009X2T(AGN-PC-0WAA41) |
| Chemical Name | 4-Bromo-5-chloro-2-ethoxyaniline |
| IUPAC Name | 4-bromo-5-chloro-2-ethoxyaniline |
| InChI | InChI=1S/C8H9BrClNO/c1-2-12-8-3-5(9)6(10)4-7(8)11/h3-4H,2,11H2,1H3 |
| InChI Key | ZYVZHJVGFUZPNT-UHFFFAOYSA-N |
| MDL Number | MFCD22421478 |
| Molecular Formula | C8H9BrClNO |
| Molecular Weight | 250.5202 |
| SMILES | CCOc1cc(Br)c(cc1N)Cl |
| Synonyms | 4-Bromo-5-chloro-2-ethoxyaniline,
1400644-28-1,
ZINC95494776,
V2992,
C8H9BrClNO,
|
| Complexity | 147 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 248.956g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 250.52g/mol |
| Monoisotopic Mass | 248.956g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number