Conjonctyl
TL;DR: Conjonctyl (CAS 21709-44-4) is a chemical compound with molecular formula C22H18O9Si and molecular weight 454.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[bis(3-carboxy-2-hydroxyphenyl)-methylsilyl]-2-hydroxybenzoic acid
Also Known As: Conjonctyl, Methylsilanetriol salicylate, 3,3',3''-(methylsilanetriyl)tris(2-hydroxybenzoic acid), Benzoic acid, 2-hydroxy-, methylsilylidyne ester, 3-[bis(3-carboxy-2-hydroxyphenyl)-methylsilyl]-2-hydroxybenzoic acid
| Molecular Formula | C22H18O9Si |
|---|---|
| Molecular Weight | 454.07 g/mol |
| LogP | 0.998 |
| Topological Polar Surface Area | 173.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 454.07202 |
| Heavy Atoms | 32 |
| Complexity | 635.0 |
Chemical Identifiers
| CAS Number | 21709-44-4 |
|---|---|
| SMILES | C[Si](C1=CC=CC(=C1O)C(=O)O)(C2=CC=CC(=C2O)C(=O)O)C3=CC=CC(=C3O)C(=O)O |
| InChIKey | LJPWBTLOVMUKJG-UHFFFAOYSA-N |
Product Overview
Conjonctyl (CAS 21709-44-4), with molecular formula C22H18O9Si and molecular weight 454.07 g/mol. IUPAC: 3-[bis(3-carboxy-2-hydroxyphenyl)-methylsilyl]-2-hydroxybenzoic acid.
Chemical Property Profile of Conjonctyl
Property Insights of Conjonctyl
The XLogP value of 0.998 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Conjonctyl. The TPSA of 173.0 Ų indicates high polarity, suggesting Conjonctyl may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Conjonctyl has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Conjonctyl?
The CAS number of Conjonctyl is 21709-44-4.
What is the molecular formula of Conjonctyl?
The molecular formula of Conjonctyl is C22H18O9Si.
What is the molecular weight of Conjonctyl?
The molecular weight of Conjonctyl is 454.07 g/mol.
Where can I buy Conjonctyl?
You can request a quote for Conjonctyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Conjonctyl?
Yes, KEHONG BIO provides custom synthesis services for Conjonctyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.