| CAS Number | 1519952-50-1 |
| Catalog Number | AG00AR4W(AGN-PC-0WAGWV) |
| Chemical Name | 2-(3,4-difluorophenyl)-1-(2-fluorophenyl)ethanone |
| IUPAC Name | 2-(3,4-difluorophenyl)-1-(2-fluorophenyl)ethanone |
| InChI | InChI=1S/C14H9F3O/c15-11-4-2-1-3-10(11)14(18)8-9-5-6-12(16)13(17)7-9/h1-7H,8H2 |
| InChI Key | GETHIDIBVZFSHH-UHFFFAOYSA-N |
| MDL Number | MFCD24969058 |
| Molecular Formula | C14H9F3O |
| Molecular Weight | 250.2159 |
| SMILES | FC1=CC=C(CC(=O)C2=CC=CC=C2F)C=C1F |
| Synonyms | 2-(3,4-Difluorophenyl)-1-(2-fluorophenyl)ethanone,
1519952-50-1,
2-(3,4-Difluorophenyl)-2'-fluoroacetophenone,
MFCD24969058,
ZINC95052139,
AKOS018941923,
ABA-8146923,
AK159009,
AS-32967,
PC421003,
AJ-131984,
AX8292507,
ST2403848,
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| Complexity | 295 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 250.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 250.22g/mol |
| Monoisotopic Mass | 250.061g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
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Certificate of Analysis
Lot Number