Diethyl 2-(benzyloxy)-2-methylmalonate
TL;DR: Diethyl 2-(benzyloxy)-2-methylmalonate (CAS 5774-69-6) is a chemical compound with molecular formula C15H20O5 and molecular weight 280.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-methyl-2-phenylmethoxypropanedioate
Also Known As: Diethyl 2-(benzyloxy)-2-methylmalonate, Diethyl (benzyloxy)methylmalonate, Diethyl Benzyloxymethylmalonate, diethyl(benzyloxy)(methyl)malonate, AMY841
| Molecular Formula | C15H20O5 |
|---|---|
| Molecular Weight | 280.13 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 280.13107 |
| Heavy Atoms | 20 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 5774-69-6 |
|---|---|
| SMILES | CCOC(=O)C(C)(C(=O)OCC)OCC1=CC=CC=C1 |
| InChIKey | AYFIAOGBVMPSAE-UHFFFAOYSA-N |
Product Overview
Diethyl 2-(benzyloxy)-2-methylmalonate (CAS 5774-69-6), with molecular formula C15H20O5 and molecular weight 280.13 g/mol. IUPAC: diethyl 2-methyl-2-phenylmethoxypropanedioate.
Chemical Property Profile of Diethyl 2-(benzyloxy)-2-methylmalonate
Property Insights of Diethyl 2-(benzyloxy)-2-methylmalonate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2-(benzyloxy)-2-methylmalonate. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-(benzyloxy)-2-methylmalonate. Following Lipinski's Rule of Five, Diethyl 2-(benzyloxy)-2-methylmalonate 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 2-(benzyloxy)-2-methylmalonate?
The CAS number of Diethyl 2-(benzyloxy)-2-methylmalonate is 5774-69-6.
What is the molecular formula of Diethyl 2-(benzyloxy)-2-methylmalonate?
The molecular formula of Diethyl 2-(benzyloxy)-2-methylmalonate is C15H20O5.
What is the molecular weight of Diethyl 2-(benzyloxy)-2-methylmalonate?
The molecular weight of Diethyl 2-(benzyloxy)-2-methylmalonate is 280.13 g/mol.
Where can I buy Diethyl 2-(benzyloxy)-2-methylmalonate?
You can request a quote for Diethyl 2-(benzyloxy)-2-methylmalonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-(benzyloxy)-2-methylmalonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-(benzyloxy)-2-methylmalonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.