2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate
TL;DR: 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate (CAS 791798-77-1) is a chemical compound with molecular formula C21H24O8 and molecular weight 404.14713 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-methoxy-4-propoxycarbonylphenyl) 3,4,5-trimethoxybenzoate
Also Known As: 2-methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate, AN-652/43161947, (2-methoxy-4-propoxycarbonylphenyl) 3,4,5-trimethoxybenzoate
Technical Specifications
| Molecular Formula | C21H24O8 |
| Molecular Weight | 404.14713 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 89.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 404.14713 Da |
| Heavy Atoms | 29 |
| Complexity | 511.0 |
| SMILES | CCCOC(=O)C1=CC(=C(C=C1)OC(=O)C2=CC(=C(C(=C2)OC)OC)OC)OC |
| InChIKey | PPNYHSLINFTPKH-UHFFFAOYSA-N |
Chemical Property Profile of 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate
Property Insights of 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate
The XLogP value of 4.0 indicates that 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate. Following Lipinski's Rule of Five, 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate?
The CAS number of 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate is 791798-77-1.
What is the molecular formula of 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate?
The molecular formula of 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate is C21H24O8.
What is the molecular weight of 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate?
The molecular weight of 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate is 404.14713 g/mol.
Where can I buy 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate?
You can request a quote for 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate?
Yes, CoreyChem provides custom synthesis services for 2-Methoxy-4-(propoxycarbonyl)phenyl 3,4,5-trimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.