| CAS Number | 951885-68-0 |
| Catalog Number | AG00IIT9(AGN-PC-0WNN6Q) |
| Chemical Name | 4-Bromo-3'-fluorobenzophenone |
| IUPAC Name | (4-bromophenyl)-(3-fluorophenyl)methanone |
| InChI | InChI=1S/C13H8BrFO/c14-11-6-4-9(5-7-11)13(16)10-2-1-3-12(15)8-10/h1-8H |
| InChI Key | CYPWUNBAFWFNPX-UHFFFAOYSA-N |
| MDL Number | MFCD09801600 |
| Molecular Formula | C13H8BrFO |
| Molecular Weight | 279.1044 |
| SMILES | BrC1C=CC(=CC=1)C(C1=CC=CC(=C1)F)=O |
| Synonyms | 4-BROMO-3'-FLUOROBENZOPHENONE,
951885-68-0,
(4-Bromophenyl)(3-fluorophenyl)methanone,
ACMC-209rxq,
SCHEMBL9357274,
CTK5I7039,
DTXSID30625669,
ANW-40476,
MFCD09801600,
ZINC11631586,
AKOS009339927,
TC-129221,
V9587,
C13H8BrFO,
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| Complexity | 248 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 277.974g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 279.108g/mol |
| Monoisotopic Mass | 277.974g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number