Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
TL;DR: Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate (CAS 121668-38-0) is a chemical compound with molecular formula C13H22O6 and molecular weight 274.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipropan-2-yl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
Also Known As: J1.123.812B, Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate, Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate #, dipropan-2-yl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate, 2,2-Dimethyl-1,3-dioxolane-4,5-dicarboxylic acid diisopropyl ester
| Molecular Formula | C13H22O6 |
|---|---|
| Molecular Weight | 274.14 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 274.14163 |
| Heavy Atoms | 19 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 121668-38-0 |
|---|---|
| SMILES | CC(C)OC(=O)C1C(OC(O1)(C)C)C(=O)OC(C)C |
| InChIKey | DSGKZMJPCBCYID-UHFFFAOYSA-N |
Product Overview
Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate (CAS 121668-38-0), with molecular formula C13H22O6 and molecular weight 274.14 g/mol. IUPAC: dipropan-2-yl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate.
Chemical Property Profile of Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
Property Insights of Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate. Following Lipinski's Rule of Five, Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate has 0 hydrogen bond donor(s) and 6 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 Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate?
The CAS number of Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate is 121668-38-0.
What is the molecular formula of Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate?
The molecular formula of Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate is C13H22O6.
What is the molecular weight of Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate?
The molecular weight of Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate is 274.14 g/mol.
Where can I buy Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate?
You can request a quote for Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diisopropyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.