Naphthalene-1,4,5-tricarboxylic acid
TL;DR: Naphthalene-1,4,5-tricarboxylic acid (CAS 3803-20-1) is a chemical compound with molecular formula C13H8O6 and molecular weight 260.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalene-1,4,5-tricarboxylic acid
Also Known As: Naphthalene-1,4,5-tricarboxylic acid, 1,4,5-Naphthalenetricarboxylic acid, 1,4,5-naphthalene tricarboxylic acid, BAS 00368002, NAPHTHALENE-1,4,8-TRICARBOXYLICACID
| Molecular Formula | C13H8O6 |
|---|---|
| Molecular Weight | 260.03 g/mol |
| LogP | 1.9344 |
| Topological Polar Surface Area | 111.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.03207 |
| Heavy Atoms | 19 |
| Complexity | 696.1404 |
Chemical Identifiers
| CAS Number | 3803-20-1 |
|---|---|
| SMILES | C1=CC2=C(C=CC(=C2C(=C1)C(=O)O)C(=O)O)C(=O)O |
Product Overview
Naphthalene-1,4,5-tricarboxylic acid (CAS 3803-20-1), with molecular formula C13H8O6 and molecular weight 260.03 g/mol. IUPAC: naphthalene-1,4,5-tricarboxylic acid.
Chemical Property Profile of Naphthalene-1,4,5-tricarboxylic acid
Property Insights of Naphthalene-1,4,5-tricarboxylic acid
The XLogP value of 1.9344 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Naphthalene-1,4,5-tricarboxylic acid. The TPSA of 111.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Naphthalene-1,4,5-tricarboxylic acid. Following Lipinski's Rule of Five, Naphthalene-1,4,5-tricarboxylic acid has 3 hydrogen bond donor(s) and 3 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 Naphthalene-1,4,5-tricarboxylic acid?
The CAS number of Naphthalene-1,4,5-tricarboxylic acid is 3803-20-1.
What is the molecular formula of Naphthalene-1,4,5-tricarboxylic acid?
The molecular formula of Naphthalene-1,4,5-tricarboxylic acid is C13H8O6.
What is the molecular weight of Naphthalene-1,4,5-tricarboxylic acid?
The molecular weight of Naphthalene-1,4,5-tricarboxylic acid is 260.03 g/mol.
Where can I buy Naphthalene-1,4,5-tricarboxylic acid?
You can request a quote for Naphthalene-1,4,5-tricarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthalene-1,4,5-tricarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for Naphthalene-1,4,5-tricarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.