| CAS Number | 1160247-44-8 |
| Catalog Number | AG00HD80(AGN-PC-0WG4I7) |
| Chemical Name | TERT-BUTYL 6-METHYL-3-OXO-2,3-DIHYDROSPIRO[INDENE-1,4'-PIPERIDINE]-1'-CARBOXYLATE |
| IUPAC Name | tert-butyl 6-methyl-3-oxospiro[2H-indene-1,4'-piperidine]-1'-carboxylate |
| InChI | InChI=1S/C19H25NO3/c1-13-5-6-14-15(11-13)19(12-16(14)21)7-9-20(10-8-19)17(22)23-18(2,3)4/h5-6,11H,7-10,12H2,1-4H3 |
| InChI Key | LRNHBSLYTKNFLA-UHFFFAOYSA-N |
| MDL Number | MFCD12198600 |
| Molecular Formula | C19H25NO3 |
| Molecular Weight | 315.4067 |
| SMILES | Cc1ccc2C(=O)CC3(CCN(CC3)C(=O)OC(C)(C)C)c2c1 |
| Synonyms | 1160247-44-8,
tert-Butyl 6-methyl-3-oxo-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate,
Tert-Butyl 6-Methyl-3-Oxo-2,3-Dihydrospiro[Indene-1,4-Piperidine]-1-Carboxylate,
MFCD12198600,
ZINC91302992,
AM804930,
CS-0036063,
t-Butyl 6-methyl-3-oxo-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate,
tert-Butyl6-methyl-3-oxo-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate,
tert-butyl 6-methyl-3-oxospiro[2H-indene-1,4'-piperidine]-1'-carboxylate,
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| Complexity | 485 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 315.183g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 315.413g/mol |
| Monoisotopic Mass | 315.183g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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