| CAS Number | 909389-74-8 |
| Catalog Number | AG01EHC6(AGN-PC-0WON9Z) |
| Chemical Name | 3,5-Dibromophenyl acetate |
| IUPAC Name | (3,5-dibromophenyl) acetate |
| InChI | InChI=1S/C8H6Br2O2/c1-5(11)12-8-3-6(9)2-7(10)4-8/h2-4H,1H3 |
| InChI Key | QPXGHGNAEBFULS-UHFFFAOYSA-N |
| MDL Number | MFCD08445663 |
| Molecular Formula | C8H6Br2O2 |
| Molecular Weight | 293.9400 |
| SMILES | CC(=O)Oc1cc(Br)cc(c1)Br |
| Synonyms | 3,5-Dibromophenyl acetate,
909389-74-8,
(3,5-dibromophenyl) acetate,
1-Acetoxy-3,5-dibromobenzene,
SCHEMBL14710190,
CTK6A1901,
ZX-AT022080,
OR6741,
ZINC16124421,
AKOS028114997,
FCH1387681,
AC-28919,
3,5-dibromophenylacetate,
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| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 293.871g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 293.942g/mol |
| Monoisotopic Mass | 291.873g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number