| CAS Number | 2221812-11-7 |
| Catalog Number | AG01FP9S(AGN-PC-3H5OK9) |
| Chemical Name | 2,6-Difluoro-3-phenylbenzaldehyde |
| IUPAC Name | 2,6-difluoro-3-phenylbenzaldehyde |
| InChI | InChI=1S/C13H8F2O/c14-12-7-6-10(13(15)11(12)8-16)9-4-2-1-3-5-9/h1-8H |
| InChI Key | GXYLQSXHNZYODU-UHFFFAOYSA-N |
| MDL Number | MFCD31619493 |
| Molecular Formula | C13H8F2O |
| Molecular Weight | 218.1988 |
| SMILES | c1(ccc(c(c1F)C=O)F)c1ccccc1 |
| Synonyms | 2221812-11-7,
2,6-Difluoro-3-phenylbenzaldehyde,
|
| Complexity | 238 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.054321g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.2g/mol |
| Monoisotopic Mass | 218.054321g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 17.1Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
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