| CAS Number | 1160247-32-4 |
| Catalog Number | AG00HD7P(AGN-PC-0WG4HX) |
| Chemical Name | tert-Butyl 6-chloro-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate |
| IUPAC Name | tert-butyl 5-chlorospiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxylate |
| InChI | InChI=1S/C18H24ClNO2/c1-17(2,3)22-16(21)20-10-8-18(9-11-20)7-6-13-4-5-14(19)12-15(13)18/h4-5,12H,6-11H2,1-3H3 |
| InChI Key | VYXHNAJIDSFZGU-UHFFFAOYSA-N |
| MDL Number | MFCD12198588 |
| Molecular Formula | C18H24ClNO2 |
| Molecular Weight | 321.8417 |
| SMILES | CC(C)(C)OC(=O)N1CCC2(CCc3ccc(Cl)cc23)CC1 |
| Synonyms | 1160247-32-4,
tert-Butyl 6-chloro-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate,
SCHEMBL4917653,
MFCD12198588,
AM804890,
t-Butyl 6-chloro-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate,
Tert-Butyl 6-Chloro-2,3-Dihydrospiro[Indene-1,4-Piperidine]-1-Carboxylate,
tert-Butyl6-chloro-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate,
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| Complexity | 423 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 321.15g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 321.845g/mol |
| Monoisotopic Mass | 321.15g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.6 |
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Certificate of Analysis
Lot Number