Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy-
TL;DR: Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy- (CAS 85273-91-2) is a chemical compound with molecular formula C16H11Cl3O6 and molecular weight 403.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[1-(3-carboxy-4-hydroxyphenyl)-2,2,2-trichloroethyl]-2-hydroxybenzoic acid
Also Known As: Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy-, 3,3'-(2,2,2-Trichloroethane-1,1-diyl)bis(6-hydroxybenzoic acid), 5-[1-(3-carboxy-4-hydroxyphenyl)-2,2,2-trichloroethyl]-2-hydroxybenzoic acid, 6,6'-dihydroxy-3,3'-(2,2,2-trichloro-ethylidene)-di-benzoic acid, 5-[1-(3-carboxy-4-hydroxy-phenyl)-2,2,2-trichloro-ethyl]-2-hydroxy-benzoic Acid
| Molecular Formula | C16H11Cl3O6 |
|---|---|
| Molecular Weight | 403.96 g/mol |
| LogP | 3.9963 |
| Topological Polar Surface Area | 115.06 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.96213 |
| Heavy Atoms | 25 |
| Complexity | 780.7491 |
Chemical Identifiers
| CAS Number | 85273-91-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(C2=CC(=C(C=C2)O)C(=O)O)C(Cl)(Cl)Cl)C(=O)O)O |
Product Overview
Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy- (CAS 85273-91-2), with molecular formula C16H11Cl3O6 and molecular weight 403.96 g/mol. IUPAC: 5-[1-(3-carboxy-4-hydroxyphenyl)-2,2,2-trichloroethyl]-2-hydroxybenzoic acid.
Chemical Property Profile of Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy-
Property Insights of Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy-
The XLogP value of 3.9963 indicates that Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy-. Following Lipinski's Rule of Five, Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy- 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 Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy-?
The CAS number of Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy- is 85273-91-2.
What is the molecular formula of Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy-?
The molecular formula of Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy- is C16H11Cl3O6.
What is the molecular weight of Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy-?
The molecular weight of Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy- is 403.96 g/mol.
Where can I buy Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy-?
You can request a quote for Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3,3'-(2,2,2-trichloroethylidene)bis[6-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.