| CAS Number | 898784-61-7 |
| Catalog Number | AG00GXT7(AGN-PC-0WCDKB) |
| Chemical Name | 2'-Bromo-2-(2-fluorophenyl)acetophenone |
| IUPAC Name | 1-(2-bromophenyl)-2-(2-fluorophenyl)ethanone |
| InChI | InChI=1S/C14H10BrFO/c15-12-7-3-2-6-11(12)14(17)9-10-5-1-4-8-13(10)16/h1-8H,9H2 |
| InChI Key | IFVYEDYXCCDOSN-UHFFFAOYSA-N |
| MDL Number | MFCD02260756 |
| Molecular Formula | C14H10BrFO |
| Molecular Weight | 293.1310 |
| SMILES | FC1=C(CC(C2=C(Br)C=CC=C2)=O)C=CC=C1 |
| Synonyms | 2'-Bromo-2-(2-fluorophenyl)acetophenone,
898784-61-7,
1-(2-bromophenyl)-2-(2-fluorophenyl)ethan-1-one,
SCHEMBL14743494,
CTK5G6199,
DTXSID10642339,
MFCD02260756,
ZINC38126797,
AKOS010312381,
MCULE-6894787355,
NE27375,
EN300-80798,
Z1258948136,
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| Complexity | 269 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 291.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 293.135g/mol |
| Monoisotopic Mass | 291.99g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
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Certificate of Analysis
Lot Number