| CAS Number | 1297540-69-2 |
| Catalog Number | AG009JDR |
| Chemical Name | 4-Bromo-3-chloro-5-fluoroaniline |
| IUPAC Name | 4-bromo-3-chloro-5-fluoroaniline |
| InChI | InChI=1S/C6H4BrClFN/c7-6-4(8)1-3(10)2-5(6)9/h1-2H,10H2 |
| InChI Key | VOPLRYDSRVEQDI-UHFFFAOYSA-N |
| MDL Number | MFCD28126799 |
| Molecular Formula | C6H4BrClFN |
| Molecular Weight | 224.4581 |
| SMILES | C1=C(C=C(C(=C1F)Br)Cl)N |
| Synonyms | 4-bromo-3-chloro-5-fluoroaniline,
1297540-69-2,
SCHEMBL1806961,
VOPLRYDSRVEQDI-UHFFFAOYSA-N,
AKOS027323928,
ZINC117172391,
Z2065788056,
|
| Complexity | 124 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.92g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.457g/mol |
| Monoisotopic Mass | 222.92g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number