| CAS Number | 1330756-35-8 |
| Catalog Number | AG00J27C(AGN-PC-0WB5J5) |
| Chemical Name | tert-butyl 7-methyl-3,7,11-triazaspiro[5.6]dodecane-3-carboxylate |
| IUPAC Name | tert-butyl 7-methyl-3,7,11-triazaspiro[5.6]dodecane-3-carboxylate |
| InChI | InChI=1S/C15H29N3O2/c1-14(2,3)20-13(19)18-10-6-15(7-11-18)12-16-8-5-9-17(15)4/h16H,5-12H2,1-4H3 |
| InChI Key | KUUNPMZOFUVVNQ-UHFFFAOYSA-N |
| MDL Number | MFCD19982712 |
| Molecular Formula | C15H29N3O2 |
| Molecular Weight | 283.4097 |
| SMILES | C(=O)(OC(C)(C)C)N1CCC2(CC1)CNCCCN2C |
| Synonyms | tert-butyl 7-methyl-3,7,11-triazaspiro[5.6]dodecane-3-carboxylate,
1330756-35-8,
ZX-CM008415,
MFCD19982712,
ZINC67425112,
AKOS027426369,
FCH1623086,
Y-8112,
|
| Complexity | 344 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 283.226g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 283.416g/mol |
| Monoisotopic Mass | 283.226g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 44.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
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Certificate of Analysis
Lot Number