| CAS Number | 1251003-15-2 |
| Catalog Number | AG00HHZO(AGN-PC-0WG4J4) |
| Chemical Name | Rcemic-(5s,9s)-tert-butyl 2-oxo-9-phenyl-1,7-diazaspiro[4.4]nonane-7-carboxylate |
| IUPAC Name | tert-butyl (5S,9S)-2-oxo-9-phenyl-1,7-diazaspiro[4.4]nonane-7-carboxylate |
| InChI | InChI=1S/C18H24N2O3/c1-17(2,3)23-16(22)20-11-14(13-7-5-4-6-8-13)18(12-20)10-9-15(21)19-18/h4-8,14H,9-12H2,1-3H3,(H,19,21)/t14-,18-/m1/s1 |
| InChI Key | OUZUSOIECSXBAV-RDTXWAMCSA-N |
| MDL Number | MFCD18791728 |
| Molecular Formula | C18H24N2O3 |
| Molecular Weight | 316.3948 |
| SMILES | CC(C)(C)OC(=O)N1C[C@H](c2ccccc2)[C@@]2(CCC(=O)N2)C1 |
| Synonyms | Rcemic-(5S,9S)-Tert-Butyl 2-Oxo-9-Phenyl-1,7-Diazaspiro[4.4]Nonane-7-Carboxylate,
1251003-15-2,
ZINC91302977,
AM804922,
CS-0036784,
2-Oxo-9-phenyl-1,7-diaza-spiro[4.4]nonane-7-carboxylic acid tert-butyl ester,
TERT-BUTYL (5S,9S)-2-OXO-9-PHENYL-1,7-DIAZASPIRO[4.4]NONANE-7-CARBOXYLATE,
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| Complexity | 479 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| 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 | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number