| CAS Number | 384-87-2 |
| Catalog Number | AG003FMG(AGN-PC-0WD2OL) |
| Chemical Name | 2,4,6-Tribromo-3-(trifluoromethyl)phenol |
| IUPAC Name | 2,4,6-tribromo-3-(trifluoromethyl)phenol |
| InChI | InChI=1S/C7H2Br3F3O/c8-2-1-3(9)6(14)5(10)4(2)7(11,12)13/h1,14H |
| InChI Key | UJGDTIJKYXZZNR-UHFFFAOYSA-N |
| MDL Number | MFCD13195740 |
| Molecular Formula | C7H2Br3F3O |
| Molecular Weight | 398.7974 |
| SMILES | Brc1cc(Br)c(c(c1C(F)(F)F)Br)O |
| Synonyms | 2,4,6-TRIBROMO-3-(TRIFLUOROMETHYL)PHENOL,
384-87-2,
ACMC-209j0c,
C7H2Br3F3O,
SCHEMBL10357215,
CTK4I0054,
DTXSID30623064,
ANW-28906,
MFCD13195740,
ZINC40456684,
AKOS015834896,
FCH1382286,
AJ-103298,
AX8257318,
TR-036666,
V5643,
B-3586,
I14-24603,
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| Complexity | 211 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 397.759g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 398.799g/mol |
| Monoisotopic Mass | 395.761g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number