Dimethyl diallylmalonate
TL;DR: Dimethyl diallylmalonate (CAS 35357-77-8) is a chemical compound with molecular formula C11H16O4 and molecular weight 212.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2,2-bis(prop-2-enyl)propanedioate
Also Known As: Dimethyl diallylmalonate, dimethyl 2,2-diallylmalonate, Diallylglutarate, DIALLYL GLUTARATE, dimethyl diallyl malonate
| Molecular Formula | C11H16O4 |
|---|---|
| Molecular Weight | 212.10 g/mol |
| LogP | 1.471 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 212.10486 |
| Heavy Atoms | 15 |
| Complexity | 239.76149 |
Chemical Identifiers
| CAS Number | 35357-77-8 |
|---|---|
| SMILES | COC(=O)C(CC=C)(CC=C)C(=O)OC |
Product Overview
Dimethyl diallylmalonate (CAS 35357-77-8), with molecular formula C11H16O4 and molecular weight 212.10 g/mol. IUPAC: dimethyl 2,2-bis(prop-2-enyl)propanedioate.
Chemical Property Profile of Dimethyl diallylmalonate
Property Insights of Dimethyl diallylmalonate
The XLogP value of 1.471 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl diallylmalonate. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl diallylmalonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl diallylmalonate 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 Dimethyl diallylmalonate?
The CAS number of Dimethyl diallylmalonate is 35357-77-8.
What is the molecular formula of Dimethyl diallylmalonate?
The molecular formula of Dimethyl diallylmalonate is C11H16O4.
What is the molecular weight of Dimethyl diallylmalonate?
The molecular weight of Dimethyl diallylmalonate is 212.10 g/mol.
Where can I buy Dimethyl diallylmalonate?
You can request a quote for Dimethyl diallylmalonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl diallylmalonate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl diallylmalonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.