Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate
TL;DR: Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate (CAS 13510-41-3) is a chemical compound with molecular formula C14H23NO5 and molecular weight 285.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate
Also Known As: N-Boc-4-oxo-L-proline tert-butyl ester, BOC-4-OXO-L-PROLINE TERT-BUTYL ESTER, Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate, (R)-N-Boc-4-oxo-L-proline tert-butyl ester, (S)-Di-tert-butyl 4-oxopyrrolidine-1,2-dicarboxylate
| Molecular Formula | C14H23NO5 |
|---|---|
| Molecular Weight | 285.16 g/mol |
| LogP | 1.9066 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 285.15762 |
| Heavy Atoms | 20 |
| Complexity | 378.26065 |
Chemical Identifiers
| CAS Number | 13510-41-3 |
|---|---|
| SMILES | CC(C)(C)OC(=O)C1CC(=O)CN1C(=O)OC(C)(C)C |
Product Overview
Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate (CAS 13510-41-3), with molecular formula C14H23NO5 and molecular weight 285.16 g/mol. IUPAC: ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate.
Chemical Property Profile of Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate
Property Insights of Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate
The XLogP value of 1.9066 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate. Following Lipinski's Rule of Five, Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate?
The CAS number of Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate is 13510-41-3.
What is the molecular formula of Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate?
The molecular formula of Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate is C14H23NO5.
What is the molecular weight of Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate?
The molecular weight of Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate is 285.16 g/mol.
Where can I buy Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate?
You can request a quote for Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ditert-butyl 4-oxopyrrolidine-1,2-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.