| CAS Number | 885453-49-6 |
| Catalog Number | AG00IF5R(AGN-PC-02TJ9Z) |
| Chemical Name | Benzenamine, 4-bromo-2-chloro-6-fluoro- |
| IUPAC Name | 4-bromo-2-chloro-6-fluoroaniline |
| InChI | InChI=1S/C6H4BrClFN/c7-3-1-4(8)6(10)5(9)2-3/h1-2H,10H2 |
| InChI Key | BMWOENOCPPYRRS-UHFFFAOYSA-N |
| MDL Number | MFCD09878163 |
| Molecular Formula | C6H4BrClFN |
| Molecular Weight | 224.4581 |
| SMILES | Brc1cc(F)c(c(c1)Cl)N |
| Synonyms | 4-Bromo-2-chloro-6-fluoroaniline,
885453-49-6,
Benzenamine, 4-bromo-2-chloro-6-fluoro-,
SCHEMBL1100748,
DTXSID40607052,
BMWOENOCPPYRRS-UHFFFAOYSA-N,
2685AJ,
MFCD09878163,
ZINC15444532,
4-bromo-2-chloro-6-fluorobenzeneamine,
AKOS017553315,
FS-4111,
Z1741967814,
C6H4BrClFN,
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| 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
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Certificate of Analysis
Lot Number