| CAS Number | 1509649-10-8 |
| Catalog Number | AG01C2YI |
| Chemical Name | tert-Butyl 1,2,3,4-tetrahydroquinoline-4-carboxylate |
| IUPAC Name | tert-butyl 1,2,3,4-tetrahydroquinoline-4-carboxylate |
| InChI | InChI=1S/C14H19NO2/c1-14(2,3)17-13(16)11-8-9-15-12-7-5-4-6-10(11)12/h4-7,11,15H,8-9H2,1-3H3 |
| InChI Key | ZUCQWEXUKWQYRO-UHFFFAOYSA-N |
| MDL Number | MFCD25630981 |
| Molecular Formula | C14H19NO2 |
| Molecular Weight | 233.3062 |
| SMILES | CC(OC(C1C2=C(C=CC=C2)NCC1)=O)(C)C |
| Synonyms | tert-butyl 1,2,3,4-tetrahydroquinoline-4-carboxylate,
1509649-10-8,
AKOS020159515,
|
| Complexity | 282 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.311g/mol |
| Monoisotopic Mass | 233.142g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number