2,3,5,6-四氯苯甲酸
TL;DR: 2,3,5,6-四氯苯甲酸 (CAS 50-38-4) is a chemical compound with molecular formula C7H2Cl4O2 and molecular weight 257.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5,6-四氯苯甲酸
2,3,5,6-tetrachlorobenzoic acid
Also Known As: 2,3,5,6-Tetrachlorobenzoic acid, Ixazomib Impurity 66, 2,3,5,6-TBA, 2,5,6-Tetrachlorobenzoic acid, Benzoic acid,3,5,6-tetrachloro
| Molecular Formula | C7H2Cl4O2 |
|---|---|
| Molecular Weight | 257.88 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 259.87793 |
| Heavy Atoms | 13 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 50-38-4 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl |
| InChIKey | UYGUFXUBSNDUFA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,5,6-四氯苯甲酸 (CAS 50-38-4), with molecular formula C7H2Cl4O2 and molecular weight 257.88 g/mol. IUPAC: 2,3,5,6-tetrachlorobenzoic acid.
Chemical Property Profile of 2,3,5,6-四氯苯甲酸
Property Insights of 2,3,5,6-四氯苯甲酸
The XLogP value of 4.1 indicates that 2,3,5,6-四氯苯甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 2,3,5,6-四氯苯甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,5,6-四氯苯甲酸 has 1 hydrogen bond donor(s) and 2 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 2,3,5,6-四氯苯甲酸?
The CAS number of 2,3,5,6-四氯苯甲酸 is 50-38-4.
What is the molecular formula of 2,3,5,6-四氯苯甲酸?
The molecular formula of 2,3,5,6-四氯苯甲酸 is C7H2Cl4O2.
What is the molecular weight of 2,3,5,6-四氯苯甲酸?
The molecular weight of 2,3,5,6-四氯苯甲酸 is 257.88 g/mol.
Where can I buy 2,3,5,6-四氯苯甲酸?
You can request a quote for 2,3,5,6-四氯苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,5,6-四氯苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 2,3,5,6-四氯苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.