| CAS Number | 228111-39-5 |
| Catalog Number | AG00I4HO(AGN-PC-0WG4V1) |
| Chemical Name | tert-Butyl 4-(2-oxoindolin-3-yl)piperidine-1-carboxylate |
| IUPAC Name | tert-butyl 4-(2-oxo-1,3-dihydroindol-3-yl)piperidine-1-carboxylate |
| InChI | InChI=1S/C18H24N2O3/c1-18(2,3)23-17(22)20-10-8-12(9-11-20)15-13-6-4-5-7-14(13)19-16(15)21/h4-7,12,15H,8-11H2,1-3H3,(H,19,21) |
| InChI Key | NMTIYHCGPJFXTJ-UHFFFAOYSA-N |
| MDL Number | MFCD12198795 |
| Molecular Formula | C18H24N2O3 |
| Molecular Weight | 316.3948 |
| SMILES | CC(C)(C)OC(=O)N1CCC(CC1)C1C(=O)Nc2ccccc12 |
| Synonyms | tert-Butyl 4-(2-oxoindolin-3-yl)piperidine-1-carboxylate,
228111-39-5,
SCHEMBL4677533,
MFCD12198795,
AM804926,
CS-0038514,
t-Butyl 4-(2-oxoindolin-3-yl)piperidine-1-carboxylate,
tert-Butyl4-(2-oxoindolin-3-yl)piperidine-1-carboxylate,
tert-butyl 4-(2-oxo-2,3-dihydro-1H-indol-3-yl)piperidine-1-carboxylate,
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| Complexity | 463 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 316.179g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 316.401g/mol |
| Monoisotopic Mass | 316.179g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 58.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
Lot Number