Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate
TL;DR: Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate (CAS 7242-93-5) is a chemical compound with molecular formula C20H33NO7 and molecular weight 399.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ditert-butyl 4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-5-oxopyrrolidine-1,2-dicarboxylate
Also Known As: Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate, Ditert-butyl 4-[(2-methylpropan-2-yl)oxycarbonylmethyl]-5-oxo-pyrrolidine-1,2-dicarboxylate, ditert-butyl 4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-5-oxopyrrolidine-1,2-dicarboxylate
| Molecular Formula | C20H33NO7 |
|---|---|
| Molecular Weight | 399.23 g/mol |
| LogP | 3.2121 |
| Topological Polar Surface Area | 99.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 399.2257 |
| Heavy Atoms | 28 |
| Complexity | 634.41034 |
Chemical Identifiers
| CAS Number | 7242-93-5 |
|---|---|
| SMILES | CC(C)(C)OC(=O)CC1CC(N(C1=O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C |
Product Overview
Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate (CAS 7242-93-5), with molecular formula C20H33NO7 and molecular weight 399.23 g/mol. IUPAC: ditert-butyl 4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-5-oxopyrrolidine-1,2-dicarboxylate.
Chemical Property Profile of Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate
Property Insights of Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate
The XLogP value of 3.2121 indicates that Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.21 Ų falls within the moderate polarity range, balancing permeability and solubility for Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate. Following Lipinski's Rule of Five, Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate has 0 hydrogen bond donor(s) and 7 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 Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate?
The CAS number of Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate is 7242-93-5.
What is the molecular formula of Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate?
The molecular formula of Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate is C20H33NO7.
What is the molecular weight of Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate?
The molecular weight of Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate is 399.23 g/mol.
Where can I buy Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate?
You can request a quote for Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-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 Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Di-tert-butyl 4-(2-tert-butoxy-2-oxoethyl)-5-oxopyrrolidine-1,2-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.