| CAS Number | 1368645-61-7 |
| Catalog Number | AG01DM45 |
| Chemical Name | 2-(4-tert-butylphenyl)pyridin-3-amine |
| IUPAC Name | 2-(4-tert-butylphenyl)pyridin-3-amine |
| InChI | InChI=1S/C15H18N2/c1-15(2,3)12-8-6-11(7-9-12)14-13(16)5-4-10-17-14/h4-10H,16H2,1-3H3 |
| InChI Key | UIUCWHHZIWITCM-UHFFFAOYSA-N |
| MDL Number | MFCD21887955 |
| Molecular Formula | C15H18N2 |
| Molecular Weight | 226.3168 |
| SMILES | CC(C)(C)c1ccc(cc1)-c1ncccc1N |
| Synonyms | 2-(4-(tert-Butyl)phenyl)pyridin-3-amine,
1368645-61-7,
AKOS019068218,
CS-0059872,
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| Complexity | 236 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.323g/mol |
| Monoisotopic Mass | 226.147g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
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Certificate of Analysis
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