| CAS Number | 871727-04-7 |
| Catalog Number | AG00IEER(AGN-PC-0VBC8F) |
| Chemical Name | 6-tert-Butyl 1-methyl 6-azaspiro[2.5]octane-1,6-dicarboxylate |
| IUPAC Name | 6-O-tert-butyl 2-O-methyl 6-azaspiro[2.5]octane-2,6-dicarboxylate |
| InChI | InChI=1S/C14H23NO4/c1-13(2,3)19-12(17)15-7-5-14(6-8-15)9-10(14)11(16)18-4/h10H,5-9H2,1-4H3 |
| InChI Key | QIDLMMIRAHZFAS-UHFFFAOYSA-N |
| MDL Number | MFCD17012788 |
| Molecular Formula | C14H23NO4 |
| Molecular Weight | 269.3367 |
| SMILES | COC(=O)C1CC11CCN(CC1)C(=O)OC(C)(C)C |
| Synonyms | 871727-04-7,
6-TERT-BUTYL 1-METHYL 6-AZASPIRO[2.5]OCTANE-1,6-DICARBOXYLATE,
SCHEMBL8214686,
MFCD17012788,
AKOS027338580,
SB12676,
AS-30226,
CS-0050148,
W-4783,
6-t-Butyl 1-methyl 6-azaspiro[2.5]octane-1,6-dicarboxylate,
6-tert-butyl1-methyl6-azaspiro[2.5]octane-1,6-dicarboxylate,
6-O-tert-butyl 2-O-methyl 6-azaspiro[2.5]octane-2,6-dicarboxylate,
6-Azaspiro[2.5]octane-1,6-dicarboxylic acid, 6-(1,1-dimethylethyl)1-methyl ester,
|
| Complexity | 377 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 269.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 269.341g/mol |
| Monoisotopic Mass | 269.163g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number