| CAS Number | 100907-37-7 |
| Catalog Number | AG00036D(AGN-PC-0L4CNM) |
| Chemical Name | Pyridine, 5-butyl-2-phenyl- |
| IUPAC Name | 5-butyl-2-phenylpyridine |
| InChI | InChI=1S/C15H17N/c1-2-3-7-13-10-11-15(16-12-13)14-8-5-4-6-9-14/h4-6,8-12H,2-3,7H2,1H3 |
| InChI Key | NHAVSAOASSCFES-UHFFFAOYSA-N |
| MDL Number | MFCD00807470 |
| Molecular Formula | C15H17N |
| Molecular Weight | 211.3022 |
| SMILES | CCCCC1=CN=C(C2=CC=CC=C2)C=C1 |
| Synonyms | 5-butyl-2-phenylpyridine,
100907-37-7,
AC1N2C6W,
Pyridine, 5-butyl-2-phenyl-,
CTK8E5211,
ZINC3108580,
MFCD00807470,
STK037884,
AKOS001567747,
MCULE-8689112159,
KS-0000003Y,
NCGC00335535-01,
CJ-10567,
TX-018063,
AB01327807-02,
SR-01000398971,
SR-01000398971-1,
ZINC03108580,
CID4044431,
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| Complexity | 184 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.308g/mol |
| Monoisotopic Mass | 211.136g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number