| CAS Number | 1784019-93-7 |
| Catalog Number | AG01ANDF |
| Chemical Name | tert-Butyl 6-(aminomethyl)-1,2,3,4-tetrahydroquinoline-1-carboxylate |
| IUPAC Name | tert-butyl 6-(aminomethyl)-3,4-dihydro-2H-quinoline-1-carboxylate |
| InChI | InChI=1S/C15H22N2O2/c1-15(2,3)19-14(18)17-8-4-5-12-9-11(10-16)6-7-13(12)17/h6-7,9H,4-5,8,10,16H2,1-3H3 |
| InChI Key | ULUXSTQSQMDTLP-UHFFFAOYSA-N |
| MDL Number | MFCD29034234 |
| Molecular Formula | C15H22N2O2 |
| Molecular Weight | 262.3474 |
| SMILES | O=C(N1CCCC2=C1C=CC(CN)=C2)OC(C)(C)C |
| Synonyms | 1784019-93-7,
tert-butyl 6-(aminomethyl)-1,2,3,4-tetrahydroquinoline-1-carboxylate,
ZINC211210157,
|
| Complexity | 325 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 262.168g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 262.353g/mol |
| Monoisotopic Mass | 262.168g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number