对茴香酸酐
TL;DR: 对茴香酸酐 (CAS 794-94-5) is a chemical compound with molecular formula C16H14O5 and molecular weight 286.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
对茴香酸酐
(4-methoxybenzoyl) 4-methoxybenzoate
Also Known As: 4-Methoxybenzoic anhydride, p-Anisic anhydride, p-Anisic acid anhydride, 4-Anisic anhydride, p-Methoxybenzoic anhydride
| Molecular Formula | C16H14O5 |
|---|---|
| Molecular Weight | 286.08 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 286.08414 |
| Heavy Atoms | 21 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 794-94-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)OC(=O)C2=CC=C(C=C2)OC |
| InChIKey | YGMHIBLUWGDWKP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
对茴香酸酐 (CAS 794-94-5), with molecular formula C16H14O5 and molecular weight 286.08 g/mol. IUPAC: (4-methoxybenzoyl) 4-methoxybenzoate.
Chemical Property Profile of 对茴香酸酐
Property Insights of 对茴香酸酐
The XLogP value of 3.2 indicates that 对茴香酸酐 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 对茴香酸酐. Following Lipinski's Rule of Five, 对茴香酸酐 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 对茴香酸酐?
The CAS number of 对茴香酸酐 is 794-94-5.
What is the molecular formula of 对茴香酸酐?
The molecular formula of 对茴香酸酐 is C16H14O5.
What is the molecular weight of 对茴香酸酐?
The molecular weight of 对茴香酸酐 is 286.08 g/mol.
Where can I buy 对茴香酸酐?
You can request a quote for 对茴香酸酐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 对茴香酸酐?
Yes, KEHONG BIO provides custom synthesis services for 对茴香酸酐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.