Diethyl bis(1-methylpropyl)malonate
TL;DR: Diethyl bis(1-methylpropyl)malonate (CAS 71501-13-8) is a chemical compound with molecular formula C15H28O4 and molecular weight 272.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2,2-di(butan-2-yl)propanedioate
Also Known As: Diethyl bis(1-methylpropyl)malonate, diethyl 2,2-di(butan-2-yl)propanedioate, Diisobutylmalonic Acid Diethyl Ester, EINECS 275-545-2, Diethyl di(butan-2-yl)propanedioate
| Molecular Formula | C15H28O4 |
|---|---|
| Molecular Weight | 272.20 g/mol |
| LogP | 3.1912 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 272.19876 |
| Heavy Atoms | 19 |
| Complexity | 268.5207 |
Chemical Identifiers
| CAS Number | 71501-13-8 |
|---|---|
| SMILES | CCC(C)C(C(C)CC)(C(=O)OCC)C(=O)OCC |
Product Overview
Diethyl bis(1-methylpropyl)malonate (CAS 71501-13-8), with molecular formula C15H28O4 and molecular weight 272.20 g/mol. IUPAC: diethyl 2,2-di(butan-2-yl)propanedioate.
Chemical Property Profile of Diethyl bis(1-methylpropyl)malonate
Property Insights of Diethyl bis(1-methylpropyl)malonate
The XLogP value of 3.1912 indicates that Diethyl bis(1-methylpropyl)malonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Diethyl bis(1-methylpropyl)malonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl bis(1-methylpropyl)malonate has 0 hydrogen bond donor(s) and 4 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 bis(1-methylpropyl)malonate?
The CAS number of Diethyl bis(1-methylpropyl)malonate is 71501-13-8.
What is the molecular formula of Diethyl bis(1-methylpropyl)malonate?
The molecular formula of Diethyl bis(1-methylpropyl)malonate is C15H28O4.
What is the molecular weight of Diethyl bis(1-methylpropyl)malonate?
The molecular weight of Diethyl bis(1-methylpropyl)malonate is 272.20 g/mol.
Where can I buy Diethyl bis(1-methylpropyl)malonate?
You can request a quote for Diethyl bis(1-methylpropyl)malonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl bis(1-methylpropyl)malonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl bis(1-methylpropyl)malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.