| CAS Number | 219963-62-9 |
| Catalog Number | AG01FERE(AGN-PC-3H4A31) |
| Chemical Name | 1-Bromo-2,5-dichloro-3-nitrobenzene |
| IUPAC Name | 1-bromo-2,5-dichloro-3-nitrobenzene |
| InChI | InChI=1S/C6H2BrCl2NO2/c7-4-1-3(8)2-5(6(4)9)10(11)12/h1-2H |
| InChI Key | XTTZFLRDPMATAY-UHFFFAOYSA-N |
| MDL Number | MFCD18379730 |
| Molecular Formula | C6H2BrCl2NO2 |
| Molecular Weight | 270.8956 |
| SMILES | Clc1cc(Br)c(c(c1)[N+](=O)[O-])Cl |
| Synonyms | 1-bromo-2,5-dichloro-3-nitrobenzene,
219963-62-9,
3-Bromo-2,5-dichloronitrobenzene,
SCHEMBL1494433,
DTXSID60593044,
XTTZFLRDPMATAY-UHFFFAOYSA-N,
3-Bromo-2,5-dichloro nitrobenzene,
ZINC67799962,
AKOS025132030,
FS-6087,
Benzene,1-bromo-2,5-dichloro-3-nitro-,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 268.865g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.891g/mol |
| Monoisotopic Mass | 268.865g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 45.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number