| CAS Number | 120694-11-3 |
| Catalog Number | AG00970B(AGN-PC-08XZ70) |
| Chemical Name | 2-Bromo-4-chloro-5-fluoro-phenylamine |
| IUPAC Name | 2-bromo-4-chloro-5-fluoroaniline |
| InChI | InChI=1S/C6H4BrClFN/c7-3-1-4(8)5(9)2-6(3)10/h1-2H,10H2 |
| InChI Key | ZPMKGKUWDFEBFB-UHFFFAOYSA-N |
| MDL Number | MFCD12026231 |
| Molecular Formula | C6H4BrClFN |
| Molecular Weight | 224.4581 |
| SMILES | NC1=CC(F)=C(C=C1Br)Cl |
| Synonyms | 2-Bromo-4-chloro-5-fluoroaniline,
120694-11-3,
2-bromo-4-chloro-5-fluoro-phenylamine,
SCHEMBL3339256,
ZPMKGKUWDFEBFB-UHFFFAOYSA-N,
MFCD12026231,
ZINC36533100,
AKOS026670831,
JS-5283,
|
| 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