Benzoic acid, 2-chloro-, diphenylsilylene ester
TL;DR: Benzoic acid, 2-chloro-, diphenylsilylene ester (CAS 129459-80-9) is a chemical compound with molecular formula C26H18Cl2O4Si and molecular weight 492.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-carboxy-2-chlorophenyl)-diphenylsilyl]-2-chlorobenzoic acid
Also Known As: Diphenyldi(o-chlorobenzoyloxy)silane, Benzoic acid, 2-chloro-, diphenylsilylene ester, Benzoic acid,2-chloro-,diphenylsilylene ester, 3,3'-(Diphenylsilanediyl)bis(2-chlorobenzoic acid), 3-[(3-carboxy-2-chlorophenyl)-diphenylsilyl]-2-chlorobenzoic acid
| Molecular Formula | C26H18Cl2O4Si |
|---|---|
| Molecular Weight | 492.04 g/mol |
| LogP | 3.7672 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 492.03516 |
| Heavy Atoms | 33 |
| Complexity | 1236.2654 |
Chemical Identifiers
| CAS Number | 129459-80-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=CC=CC(=C3Cl)C(=O)O)C4=CC=CC(=C4Cl)C(=O)O |
Product Overview
Benzoic acid, 2-chloro-, diphenylsilylene ester (CAS 129459-80-9), with molecular formula C26H18Cl2O4Si and molecular weight 492.04 g/mol. IUPAC: 3-[(3-carboxy-2-chlorophenyl)-diphenylsilyl]-2-chlorobenzoic acid.
Chemical Property Profile of Benzoic acid, 2-chloro-, diphenylsilylene ester
Property Insights of Benzoic acid, 2-chloro-, diphenylsilylene ester
The XLogP value of 3.7672 indicates that Benzoic acid, 2-chloro-, diphenylsilylene ester 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, 2-chloro-, diphenylsilylene ester. Following Lipinski's Rule of Five, Benzoic acid, 2-chloro-, diphenylsilylene ester 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, 2-chloro-, diphenylsilylene ester?
The CAS number of Benzoic acid, 2-chloro-, diphenylsilylene ester is 129459-80-9.
What is the molecular formula of Benzoic acid, 2-chloro-, diphenylsilylene ester?
The molecular formula of Benzoic acid, 2-chloro-, diphenylsilylene ester is C26H18Cl2O4Si.
What is the molecular weight of Benzoic acid, 2-chloro-, diphenylsilylene ester?
The molecular weight of Benzoic acid, 2-chloro-, diphenylsilylene ester is 492.04 g/mol.
Where can I buy Benzoic acid, 2-chloro-, diphenylsilylene ester?
You can request a quote for Benzoic acid, 2-chloro-, diphenylsilylene ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-chloro-, diphenylsilylene ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-chloro-, diphenylsilylene ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.