| CAS Number | 1686126-88-4 |
| Catalog Number | AG01FNSO(AGN-PC-3H4BIA) |
| Chemical Name | 4,5-Dimethyl-2-(4-methylphenyl)pyridine |
| IUPAC Name | 4,5-dimethyl-2-(4-methylphenyl)pyridine |
| InChI | InChI=1S/C14H15N/c1-10-4-6-13(7-5-10)14-8-11(2)12(3)9-15-14/h4-9H,1-3H3 |
| InChI Key | ZXHGRQDLBQZPAP-UHFFFAOYSA-N |
| MDL Number | MFCD32206245 |
| Molecular Formula | C14H15N |
| Molecular Weight | 197.2756 |
| SMILES | CC1=CC(=NC=C1C)C1=CC=C(C=C1)C |
| Synonyms | SCHEMBL18729621,
4,5-Dimethyl-2-(p-tolyl)pyridine,
1686126-88-4,
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| Complexity | 194 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.12g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.281g/mol |
| Monoisotopic Mass | 197.12g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
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Certificate of Analysis
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