| CAS Number | 1363210-32-5 |
| Catalog Number | AG00HUIB(AGN-PC-0WG4G4) |
| Chemical Name | 8-Tert-Butyl 2-Methyl 8-Azaspiro[4.5]Dec-1-Ene-2,8-Dicarboxylate |
| IUPAC Name | 8-O-tert-butyl 3-O-methyl 8-azaspiro[4.5]dec-3-ene-3,8-dicarboxylate |
| InChI | InChI=1S/C16H25NO4/c1-15(2,3)21-14(19)17-9-7-16(8-10-17)6-5-12(11-16)13(18)20-4/h11H,5-10H2,1-4H3 |
| InChI Key | GIHYLCNWUSJPST-UHFFFAOYSA-N |
| MDL Number | MFCD22209685 |
| Molecular Formula | C16H25NO4 |
| Molecular Weight | 295.3740 |
| SMILES | COC(=O)C1=CC2(CC1)CCN(CC2)C(=O)OC(C)(C)C |
| Synonyms | 1363210-32-5,
8-tert-Butyl 2-methyl 8-azaspiro[4.5]dec-1-ene-2,8-dicarboxylate,
MFCD22209685,
AM805066,
CS-0038442,
8-t-Butyl 2-methyl 8-azaspiro[4.5]dec-1-ene-2,8-dicarboxylate,
8-tert-butyl2-methyl8-azaspiro[4.5]dec-1-ene-2,8-dicarboxylate,
8-(tert-Butyl) 2-methyl 8-azaspiro[4.5]dec-1-ene-2,8-dicarboxylate,
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| Complexity | 453 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 295.178g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 295.379g/mol |
| Monoisotopic Mass | 295.178g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number