Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis-
TL;DR: Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis- (CAS 34375-61-6) is a chemical compound with molecular formula C16H11Cl3O4 and molecular weight 371.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[1-(4-carboxyphenyl)-2,2,2-trichloroethyl]benzoic acid
Also Known As: 1,5-Bis-octadecylamino-anthraquinone, Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis-, 4,4'-(2,2,2-trichloroethane-1,1-diyl)dibenzoic acid, 2,2-bis-(p-carboxyphenyl)1,1,1-trichloro-ethane, 4-[1-(4-carboxyphenyl)-2,2,2-trichloroethyl]benzoic acid
| Molecular Formula | C16H11Cl3O4 |
|---|---|
| Molecular Weight | 371.97 g/mol |
| LogP | 4.5851 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.9723 |
| Heavy Atoms | 23 |
| Complexity | 660.9857 |
Chemical Identifiers
| CAS Number | 34375-61-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C(C2=CC=C(C=C2)C(=O)O)C(Cl)(Cl)Cl)C(=O)O |
Product Overview
Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis- (CAS 34375-61-6), with molecular formula C16H11Cl3O4 and molecular weight 371.97 g/mol. IUPAC: 4-[1-(4-carboxyphenyl)-2,2,2-trichloroethyl]benzoic acid.
Chemical Property Profile of Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis-
Property Insights of Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis-
The XLogP value of 4.5851 indicates that Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis-. Following Lipinski's Rule of Five, Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis- has 2 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 Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis-?
The CAS number of Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis- is 34375-61-6.
What is the molecular formula of Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis-?
The molecular formula of Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis- is C16H11Cl3O4.
What is the molecular weight of Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis-?
The molecular weight of Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis- is 371.97 g/mol.
Where can I buy Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis-?
You can request a quote for Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4,4'-(2,2,2-trichloroethylidene)bis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.