3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid
TL;DR: 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid (CAS 69791-82-8) is a chemical compound with molecular formula C14H16O5 and molecular weight 264.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6,7-trimethoxy-3,4-dihydronaphthalene-2-carboxylic acid
Also Known As: 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid, EINECS 274-119-3, 5,6,7-Trimethoxy-3,4-dihydro-2-naphthoic acid, 5,6,7-trimethoxy-3,4-dihydronaphthalene-2-carboxylic acid, 3,4-Dihydro-5,6,7-trimethoxy-2-naphthalenecarboxylic acid
| Molecular Formula | C14H16O5 |
|---|---|
| Molecular Weight | 264.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.09976 |
| Heavy Atoms | 19 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 69791-82-8 |
|---|---|
| SMILES | COC1=C(C(=C2CCC(=CC2=C1)C(=O)O)OC)OC |
| InChIKey | QJWPWKFTQLFTKD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid (CAS 69791-82-8), with molecular formula C14H16O5 and molecular weight 264.10 g/mol. IUPAC: 5,6,7-trimethoxy-3,4-dihydronaphthalene-2-carboxylic acid.
Chemical Property Profile of 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid
Property Insights of 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid. Following Lipinski's Rule of Five, 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid has 1 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 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid?
The CAS number of 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid is 69791-82-8.
What is the molecular formula of 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid?
The molecular formula of 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid is C14H16O5.
What is the molecular weight of 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid?
The molecular weight of 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid is 264.10 g/mol.
Where can I buy 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid?
You can request a quote for 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydro-5,6,7-trimethoxy-2-naphthoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.