| CAS Number | 392-92-7 |
| Catalog Number | AG00CU0I(AGN-PC-00NZ00) |
| Chemical Name | 2,4-Dibromo-6-trifluoromethylphenol |
| IUPAC Name | 2,4-dibromo-6-(trifluoromethyl)phenol |
| InChI | InChI=1S/C7H3Br2F3O/c8-3-1-4(7(10,11)12)6(13)5(9)2-3/h1-2,13H |
| InChI Key | DJPAQOCIUDXBHK-UHFFFAOYSA-N |
| MDL Number | MFCD11226207 |
| Molecular Formula | C7H3Br2F3O |
| Molecular Weight | 319.9013 |
| SMILES | c1(cc(cc(c1O)Br)Br)C(F)(F)F |
| Synonyms | 2,4-Dibromo-6-(trifluoromethyl)phenol,
392-92-7,
2,4-Dibromo-6-trifluoromethylphenol,
SCHEMBL282136,
CTK8I5658,
DTXSID40549403,
AKOS027322899,
Phenol, 2,4-dibromo-6-(trifluoromethyl)-,
TL8007252,
|
| Complexity | 185 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 319.848g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 319.903g/mol |
| Monoisotopic Mass | 317.85g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number