| CAS Number | 1000576-44-2 |
| Catalog Number | AG00H956(AGN-PC-0WRACC) |
| Chemical Name | 2,5-Dibromo-6-fluorotoluene |
| IUPAC Name | 1,4-dibromo-2-fluoro-3-methylbenzene |
| InChI | InChI=1S/C7H5Br2F/c1-4-5(8)2-3-6(9)7(4)10/h2-3H,1H3 |
| InChI Key | DIHFJZRFCAKXCU-UHFFFAOYSA-N |
| MDL Number | MFCD09800767 |
| Molecular Formula | C7H5Br2F |
| Molecular Weight | 267.9210 |
| SMILES | Brc1ccc(c(c1F)C)Br |
| Synonyms | 2,5-Dibromo-6-fluorotoluene,
1000576-44-2,
1,4-dibromo-2-fluoro-3-methylbenzene,
3,6-Dibromo-2-fluorotoluene,
ZINC63339586,
FS-5794,
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| Complexity | 118 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.872g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.923g/mol |
| Monoisotopic Mass | 265.874g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
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Certificate of Analysis
Lot Number