2,4,6-Trihydroxybenzoic acid monohydrate
TL;DR: 2,4,6-Trihydroxybenzoic acid monohydrate (CAS 71989-93-0) is a chemical compound with molecular formula C7H8O6 and molecular weight 188.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trihydroxybenzoic acid;hydrate
Also Known As: 2,4,6-trihydroxybenzoic acid hydrate, 2,4,6-Trihydroxybenzoic acid monohydrate, 2,4,6-trihydroxybenzoate, Phloroglucinolcarboxylic acid, 2,4,6-trihydroxybenzoic acid;hydrate
| Molecular Formula | C7H8O6 |
|---|---|
| Molecular Weight | 188.03 g/mol |
| LogP | -0.3231 |
| Topological Polar Surface Area | 129.49 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.03209 |
| Heavy Atoms | 13 |
| Complexity | 308.74982 |
Chemical Identifiers
| CAS Number | 71989-93-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1O)C(=O)O)O)O.O |
Product Overview
2,4,6-Trihydroxybenzoic acid monohydrate (CAS 71989-93-0), with molecular formula C7H8O6 and molecular weight 188.03 g/mol. IUPAC: 2,4,6-trihydroxybenzoic acid;hydrate.
Chemical Property Profile of 2,4,6-Trihydroxybenzoic acid monohydrate
Property Insights of 2,4,6-Trihydroxybenzoic acid monohydrate
The XLogP value of -0.3231 indicates that 2,4,6-Trihydroxybenzoic acid monohydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 129.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4,6-Trihydroxybenzoic acid monohydrate. Following Lipinski's Rule of Five, 2,4,6-Trihydroxybenzoic acid monohydrate has 4 hydrogen bond donor(s) and 4 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 2,4,6-Trihydroxybenzoic acid monohydrate?
The CAS number of 2,4,6-Trihydroxybenzoic acid monohydrate is 71989-93-0.
What is the molecular formula of 2,4,6-Trihydroxybenzoic acid monohydrate?
The molecular formula of 2,4,6-Trihydroxybenzoic acid monohydrate is C7H8O6.
What is the molecular weight of 2,4,6-Trihydroxybenzoic acid monohydrate?
The molecular weight of 2,4,6-Trihydroxybenzoic acid monohydrate is 188.03 g/mol.
Where can I buy 2,4,6-Trihydroxybenzoic acid monohydrate?
You can request a quote for 2,4,6-Trihydroxybenzoic acid monohydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Trihydroxybenzoic acid monohydrate?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Trihydroxybenzoic acid monohydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.