| CAS Number | 1955524-38-5 |
| Catalog Number | AG01B28T |
| Chemical Name | 1,4-bis[(tert-butoxy)carbonyl]piperidine-4-carboxylic acid |
| IUPAC Name | 1,4-bis[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid |
| InChI | InChI=1S/C16H27NO6/c1-14(2,3)22-12(20)16(11(18)19)7-9-17(10-8-16)13(21)23-15(4,5)6/h7-10H2,1-6H3,(H,18,19) |
| InChI Key | RBASNIDERRGEFR-UHFFFAOYSA-N |
| MDL Number | MFCD30180421 |
| Molecular Formula | C16H27NO6 |
| Molecular Weight | 329.3887 |
| SMILES | CC(OC(N1CCC(C(OC(C)(C)C)=O)(C(O)=O)CC1)=O)(C)C |
| Synonyms | 1,4-bis[(tert-butoxy)carbonyl]piperidine-4-carboxylic acid,
1955524-38-5,
AKOS033937402,
ZINC407986224,
Z2526439828,
|
| Complexity | 478 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 329.184g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 329.393g/mol |
| Monoisotopic Mass | 329.184g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 93.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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