Diethyl isopropylbenzyloxymalonate
TL;DR: Diethyl isopropylbenzyloxymalonate (CAS 24124-03-6) is a chemical compound with molecular formula C17H24O5 and molecular weight 308.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-phenylmethoxy-2-propan-2-ylpropanedioate
Also Known As: Diethyl isopropylbenzyloxymalonate, DITHIANON, diethylisopropylbenzyloxymalonate, 2-Isopropyl-2-(benzyloxy)-propanedioic Acid 1,3-Diethyl Ester, diethyl(benzyloxy)(isopropyl)malonate
| Molecular Formula | C17H24O5 |
|---|---|
| Molecular Weight | 308.16 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 308.16238 |
| Heavy Atoms | 22 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 24124-03-6 |
|---|---|
| SMILES | CCOC(=O)C(C(C)C)(C(=O)OCC)OCC1=CC=CC=C1 |
| InChIKey | LRMLTYOJCFBKLZ-UHFFFAOYSA-N |
Product Overview
Diethyl isopropylbenzyloxymalonate (CAS 24124-03-6), with molecular formula C17H24O5 and molecular weight 308.16 g/mol. IUPAC: diethyl 2-phenylmethoxy-2-propan-2-ylpropanedioate.
Chemical Property Profile of Diethyl isopropylbenzyloxymalonate
Property Insights of Diethyl isopropylbenzyloxymalonate
The XLogP value of 3.5 indicates that Diethyl isopropylbenzyloxymalonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl isopropylbenzyloxymalonate. Following Lipinski's Rule of Five, Diethyl isopropylbenzyloxymalonate 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 Diethyl isopropylbenzyloxymalonate?
The CAS number of Diethyl isopropylbenzyloxymalonate is 24124-03-6.
What is the molecular formula of Diethyl isopropylbenzyloxymalonate?
The molecular formula of Diethyl isopropylbenzyloxymalonate is C17H24O5.
What is the molecular weight of Diethyl isopropylbenzyloxymalonate?
The molecular weight of Diethyl isopropylbenzyloxymalonate is 308.16 g/mol.
Where can I buy Diethyl isopropylbenzyloxymalonate?
You can request a quote for Diethyl isopropylbenzyloxymalonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl isopropylbenzyloxymalonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl isopropylbenzyloxymalonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.