| CAS Number | 1160246-77-4 |
| Catalog Number | AG00HD76(AGN-PC-0WG4E1) |
| Chemical Name | benzyl 2-oxo-1,9-diazaspiro[5.5]undecane-9-carboxylate |
| IUPAC Name | benzyl 2-oxo-1,9-diazaspiro[5.5]undecane-9-carboxylate |
| InChI | InChI=1S/C17H22N2O3/c20-15-7-4-8-17(18-15)9-11-19(12-10-17)16(21)22-13-14-5-2-1-3-6-14/h1-3,5-6H,4,7-13H2,(H,18,20) |
| InChI Key | JZZHPDJMZLKVPE-UHFFFAOYSA-N |
| MDL Number | MFCD12198510 |
| Molecular Formula | C17H22N2O3 |
| Molecular Weight | 302.3682 |
| SMILES | O=C(OCc1ccccc1)N1CCC2(CCCC(=O)N2)CC1 |
| Synonyms | BENZYL 2-OXO-1,9-DIAZASPIRO[5.5]UNDECANE-9-CARBOXYLATE,
1160246-77-4,
MFCD12198510,
ZINC91303114,
PB23997,
AM805010,
CS-0037910,
Q-4076,
Benzyl2-oxo-1,9-diazaspiro[5.5]undecane-9-carboxylate,
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| Complexity | 410 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 302.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 302.374g/mol |
| Monoisotopic Mass | 302.163g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 58.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number