| CAS Number | 123734-38-3 |
| Catalog Number | AG01A3EA |
| Chemical Name | 3-(4-Phenylbenzoyl)pyridine |
| IUPAC Name | (4-phenylphenyl)-pyridin-3-ylmethanone |
| InChI | InChI=1S/C18H13NO/c20-18(17-7-4-12-19-13-17)16-10-8-15(9-11-16)14-5-2-1-3-6-14/h1-13H |
| InChI Key | DRIKHOZQBVFKPA-UHFFFAOYSA-N |
| MDL Number | MFCD13660852 |
| Molecular Formula | C18H13NO |
| Molecular Weight | 259.3019 |
| SMILES | O=C(C1=CN=CC=C1)C1=CC=C(C2=CC=CC=C2)C=C1 |
| Synonyms | 3-(4-phenylbenzoyl)pyridine,
123734-38-3,
SCHEMBL9792676,
ZINC34403957,
AKOS009338625,
NE52157,
|
| Complexity | 313 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 259.308g/mol |
| Monoisotopic Mass | 259.1g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 30A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number