Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate
TL;DR: Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate (CAS 180844-05-7) is a chemical compound with molecular formula C18H18O7 and molecular weight 346.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methoxy-4-methoxycarbonylphenyl) 3,4-dimethoxybenzoate
Also Known As: 2-METHOXY-4-(METHOXYCARBONYL)PHENYL 3,4-DIMETHOXYBENZOATE, methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate, (2-methoxy-4-methoxycarbonylphenyl) 3,4-dimethoxybenzoate
| Molecular Formula | C18H18O7 |
|---|---|
| Molecular Weight | 346.11 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 346.10526 |
| Heavy Atoms | 25 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 180844-05-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(=O)OC)OC)OC |
| InChIKey | HRXBDFBHZFNGRK-UHFFFAOYSA-N |
Product Overview
Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate (CAS 180844-05-7), with molecular formula C18H18O7 and molecular weight 346.11 g/mol. IUPAC: (2-methoxy-4-methoxycarbonylphenyl) 3,4-dimethoxybenzoate.
Chemical Property Profile of Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate
Property Insights of Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate
The XLogP value of 3.1 indicates that Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate. Following Lipinski's Rule of Five, Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate has 0 hydrogen bond donor(s) and 7 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 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate?
The CAS number of Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate is 180844-05-7.
What is the molecular formula of Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate?
The molecular formula of Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate is C18H18O7.
What is the molecular weight of Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate?
The molecular weight of Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate is 346.11 g/mol.
Where can I buy Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate?
You can request a quote for Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-{[(3,4-dimethoxyphenyl)carbonyl]oxy}-3-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.