| CAS Number | 1000574-47-9 |
| Catalog Number | AG00H950(AGN-PC-0WRACM) |
| Chemical Name | 4-Chloro-2,3-difluorobromobenzene |
| IUPAC Name | 1-bromo-4-chloro-2,3-difluorobenzene |
| InChI | InChI=1S/C6H2BrClF2/c7-3-1-2-4(8)6(10)5(3)9/h1-2H |
| InChI Key | NLNGUQIWICXNKO-UHFFFAOYSA-N |
| MDL Number | MFCD09878201 |
| Molecular Formula | C6H2BrClF2 |
| Molecular Weight | 227.4339 |
| SMILES | ClC1=C(C(=C(C=C1)Br)F)F |
| Synonyms | 4-Chloro-2,3-difluorobromobenzene,
1000574-47-9,
1-bromo-4-chloro-2,3-difluorobenzene,
SCHEMBL2014602,
NLNGUQIWICXNKO-UHFFFAOYSA-N,
ZINC63339659,
AKOS026671377,
FS-6236,
Benzene,1-bromo-4-chloro-2,3-difluoro-,
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| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.9g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.433g/mol |
| Monoisotopic Mass | 225.9g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number