Methyl ethyl phthalate
TL;DR: Methyl ethyl phthalate (CAS 34006-77-4) is a chemical compound with molecular formula C11H12O4 and molecular weight 208.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-O-ethyl 1-O-methyl benzene-1,2-dicarboxylate
Also Known As: ethyl methyl phthalate, METHYL ETHYL PHTHALATE, methylethyl phthalate, ethyl-methyl phthalate, 1-Ethyl 2-methyl phthalate #
| Molecular Formula | C11H12O4 |
|---|---|
| Molecular Weight | 208.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 208.07356 |
| Heavy Atoms | 15 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 34006-77-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=CC=C1C(=O)OC |
| InChIKey | HGERXYZHJFOFNE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl ethyl phthalate (CAS 34006-77-4), with molecular formula C11H12O4 and molecular weight 208.07 g/mol. IUPAC: 2-O-ethyl 1-O-methyl benzene-1,2-dicarboxylate.
Chemical Property Profile of Methyl ethyl phthalate
Property Insights of Methyl ethyl phthalate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl ethyl phthalate. With a topological polar surface area (TPSA) of 52.6 Ų, Methyl ethyl phthalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl ethyl phthalate 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 Methyl ethyl phthalate?
The CAS number of Methyl ethyl phthalate is 34006-77-4.
What is the molecular formula of Methyl ethyl phthalate?
The molecular formula of Methyl ethyl phthalate is C11H12O4.
What is the molecular weight of Methyl ethyl phthalate?
The molecular weight of Methyl ethyl phthalate is 208.07 g/mol.
Where can I buy Methyl ethyl phthalate?
You can request a quote for Methyl ethyl phthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl ethyl phthalate?
Yes, KEHONG BIO provides custom synthesis services for Methyl ethyl phthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.