| CAS Number | 56970-93-5 |
| Catalog Number | AG01EHR6(AGN-PC-0JERHQ) |
| Chemical Name | Pyridin-3-yl(pyridin-4-yl)methanone |
| IUPAC Name | pyridin-3-yl(pyridin-4-yl)methanone |
| InChI | InChI=1S/C11H8N2O/c14-11(9-3-6-12-7-4-9)10-2-1-5-13-8-10/h1-8H |
| InChI Key | PKNBEXFZRUHWSZ-UHFFFAOYSA-N |
| MDL Number | MFCD03084287 |
| Molecular Formula | C11H8N2O |
| Molecular Weight | 184.1940 |
| SMILES | C(C1=CC=NC=C1)(=O)C1C=CC=NC=1 |
| Synonyms | pyridin-3-yl(pyridin-4-yl)methanone,
56970-93-5,
3,4'-dipyridylketone,
AC1NDI5J,
3-Pyridyl(4-pyridyl) ketone,
SCHEMBL18228407,
MFCD03084287,
Pyridin-3-yl-pyridin-4-yl-methanone,
[2,3'-Bipyridine]-4'-carbaldehyde,
CID4601630,
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| Complexity | 200 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.198g/mol |
| Monoisotopic Mass | 184.064g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
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