| CAS Number | 223794-97-6 |
| Catalog Number | AG00IMP0(AGN-PC-03RWX1) |
| Chemical Name | 1-(5-Phenylpyridin-3-yl)piperazine |
| IUPAC Name | 1-(5-phenylpyridin-3-yl)piperazine |
| InChI | InChI=1S/C15H17N3/c1-2-4-13(5-3-1)14-10-15(12-17-11-14)18-8-6-16-7-9-18/h1-5,10-12,16H,6-9H2 |
| InChI Key | UTJLUZMSRMFBNA-UHFFFAOYSA-N |
| MDL Number | MFCD26390882 |
| Molecular Formula | C15H17N3 |
| Molecular Weight | 239.3156 |
| SMILES | N1(C2=CC(C3=CC=CC=C3)=CN=C2)CCNCC1 |
| Synonyms | 1-(5-phenylpyridin-3-yl)piperazine,
223794-97-6,
1-(5-phenyl-pyridin-3-yl)-piperazine,
SCHEMBL3453352,
MFCD26390882,
AK361557,
DS-12847,
|
| Complexity | 244 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.322g/mol |
| Monoisotopic Mass | 239.142g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 28.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number