| CAS Number | 943830-81-7 |
| Catalog Number | AG00II48 |
| Chemical Name | 3-Bromo-6-chloro-2-fluoroaniline |
| IUPAC Name | 3-bromo-6-chloro-2-fluoroaniline |
| InChI | InChI=1S/C6H4BrClFN/c7-3-1-2-4(8)6(10)5(3)9/h1-2H,10H2 |
| InChI Key | YBQMYAOZKDEJHG-UHFFFAOYSA-N |
| MDL Number | MFCD27934056 |
| Molecular Formula | C6H4BrClFN |
| Molecular Weight | 224.4581 |
| SMILES | BrC=1C(=C(N)C(=CC1)Cl)F |
| Synonyms | 3-bromo-6-chloro-2-fluoroaniline,
943830-81-7,
SCHEMBL1224150,
YBQMYAOZKDEJHG-UHFFFAOYSA-N,
MFCD27934056,
ZINC75915343,
AKOS023126065,
FCH2501584,
PC500489,
PS-10197,
Benzenamine, 3-bromo-6-chloro-2-fluoro-,
AS-813/43501813,
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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