| CAS Number | 1211536-17-2 |
| Catalog Number | AG01C2XP |
| Chemical Name | (4-tert-butylpyridin-3-yl)methanamine |
| IUPAC Name | (4-tert-butylpyridin-3-yl)methanamine |
| InChI | InChI=1S/C10H16N2/c1-10(2,3)9-4-5-12-7-8(9)6-11/h4-5,7H,6,11H2,1-3H3 |
| InChI Key | CIXTUEIOJAOKTI-UHFFFAOYSA-N |
| MDL Number | MFCD18254157 |
| Molecular Formula | C10H16N2 |
| Molecular Weight | 164.2474 |
| SMILES | CC(C1=C(CN)C=NC=C1)(C)C |
| Synonyms | (4-tert-butylpyridin-3-yl)methanamine,
1211536-17-2,
ZINC107456726,
|
| Complexity | 137 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 164.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.252g/mol |
| Monoisotopic Mass | 164.131g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
Lot Number