| CAS Number | 903094-72-4 |
| Catalog Number | AG00H08Q(AGN-PC-0WCZS4) |
| Chemical Name | 1-(1-TERT-BUTOXYCARBONYL-PYRROLIDIN-3-YL)-PIPERIDINE-3-CARBOXYLIC ACID |
| IUPAC Name | 1-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]piperidine-3-carboxylic acid |
| InChI | InChI=1S/C15H26N2O4/c1-15(2,3)21-14(20)17-8-6-12(10-17)16-7-4-5-11(9-16)13(18)19/h11-12H,4-10H2,1-3H3,(H,18,19) |
| InChI Key | JYXSUUXDUDDEIX-UHFFFAOYSA-N |
| MDL Number | MFCD06657439 |
| Molecular Formula | C15H26N2O4 |
| Molecular Weight | 298.3779 |
| SMILES | CC(C)(C)OC(=O)N1CCC(C1)N1CCCC(C1)C(O)=O |
| Synonyms | 903094-72-4,
1-(1-(tert-Butoxycarbonyl)pyrrolidin-3-yl)piperidine-3-carboxylic acid,
1-(1-TERT-BUTOXYCARBONYL-PYRROLIDIN-3-YL)-PIPERIDINE-3-CARBOXYLIC ACID,
1-[1-(tert-Butoxycarbonyl)pyrrolidin-3-yl]piperidine-3-carboxylic acid,
CTK7I9464,
DTXSID10659700,
AB3273,
MFCD06657439,
AKOS022172028,
AS-44699,
AX8169998,
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| Complexity | 405 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 298.189g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 298.383g/mol |
| Monoisotopic Mass | 298.189g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 70.1A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.9 |
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Certificate of Analysis
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