| CAS Number | 1823271-87-9 |
| Catalog Number | AG019EMV(AGN-PC-0WG4H1) |
| Chemical Name | tert-Butyl 2-((benzyloxy)methyl)-1,8-diazaspiro[4.5]decane-8-carboxylate |
| IUPAC Name | tert-butyl 2-(phenylmethoxymethyl)-1,8-diazaspiro[4.5]decane-8-carboxylate |
| InChI | InChI=1S/C21H32N2O3/c1-20(2,3)26-19(24)23-13-11-21(12-14-23)10-9-18(22-21)16-25-15-17-7-5-4-6-8-17/h4-8,18,22H,9-16H2,1-3H3 |
| InChI Key | IBPUOPZDGOEOMN-UHFFFAOYSA-N |
| MDL Number | MFCD27997371 |
| Molecular Formula | C21H32N2O3 |
| Molecular Weight | 360.4904 |
| SMILES | CC(C)(C)OC(=O)N1CCC2(CCC(COCc3ccccc3)N2)CC1 |
| Synonyms | 1823271-87-9,
tert-Butyl 2-((benzyloxy)methyl)-1,8-diazaspiro[4.5]decane-8-carboxylate,
MFCD27997371,
AKOS027430116,
CS-0038315,
t-Butyl 2-((benzyloxy)methyl)-1,8-diazaspiro[4.5]decane-8-carboxylate,
Tert-Butyl 2-((Benzyloxy)Methyl)-1,8-Diazaspiro[4.5]Decane-8-Carboxylate(WX101545),
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| Complexity | 460 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 360.241g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 360.498g/mol |
| Monoisotopic Mass | 360.241g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 50.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number