| CAS Number | 108574-98-7 |
| Catalog Number | AG0083KD(AGN-PC-00NFBL) |
| Chemical Name | Benzaldehyde, 4-bromo-2,3,5,6-tetrafluoro- |
| IUPAC Name | 4-bromo-2,3,5,6-tetrafluorobenzaldehyde |
| InChI | InChI=1S/C7HBrF4O/c8-3-6(11)4(9)2(1-13)5(10)7(3)12/h1H |
| InChI Key | ABQIERQXAUMNCS-UHFFFAOYSA-N |
| MDL Number | MFCD31652790 |
| Molecular Formula | C7HBrF4O |
| Molecular Weight | 256.9799 |
| SMILES | O=Cc1c(F)c(F)c(c(c1F)F)Br |
| Synonyms | 4-bromo-2,3,5,6-tetrafluorobenzaldehyde,
108574-98-7,
Benzaldehyde, 4-bromo-2,3,5,6-tetrafluoro-,
ACMC-20mblp,
SCHEMBL9322221,
CTK0D6290,
DTXSID80546335,
ABQIERQXAUMNCS-UHFFFAOYSA-N,
CS-0059751,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 255.915g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.982g/mol |
| Monoisotopic Mass | 255.915g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number