Benzoic acid, 4-bromo-, diphenylsilylene ester
TL;DR: Benzoic acid, 4-bromo-, diphenylsilylene ester (CAS 129459-85-4) is a chemical compound with molecular formula C26H18Br2O4Si and molecular weight 579.9341 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromo-2-[(5-bromo-2-carboxyphenyl)-diphenylsilyl]benzoic acid
Also Known As: Diphenylsilylene 4-bromobenzoate, Benzoic acid, 4-bromo-, diphenylsilylene ester, 2,2'-(Diphenylsilanediyl)bis(4-bromobenzoic acid), 4-bromo-2-[(5-bromo-2-carboxyphenyl)-diphenylsilyl]benzoic acid, BRN 4768409
Technical Specifications
| Molecular Formula | C26H18Br2O4Si |
| Molecular Weight | 579.9341 g/mol |
| XLogP | 3.9854 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 579.9341 Da |
| Heavy Atoms | 33 |
| Complexity | 634.0 |
| SMILES | C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=C(C=CC(=C3)Br)C(=O)O)C4=C(C=CC(=C4)Br)C(=O)O |
| InChIKey | VDCVXWYFVKBEOI-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 4-bromo-, diphenylsilylene ester
Property Insights of Benzoic acid, 4-bromo-, diphenylsilylene ester
The XLogP value of 3.9854 indicates that Benzoic acid, 4-bromo-, 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, 4-bromo-, diphenylsilylene ester. Following Lipinski's Rule of Five, Benzoic acid, 4-bromo-, diphenylsilylene ester has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Benzoic acid, 4-bromo-, diphenylsilylene ester?
The CAS number of Benzoic acid, 4-bromo-, diphenylsilylene ester is 129459-85-4.
What is the molecular formula of Benzoic acid, 4-bromo-, diphenylsilylene ester?
The molecular formula of Benzoic acid, 4-bromo-, diphenylsilylene ester is C26H18Br2O4Si.
What is the molecular weight of Benzoic acid, 4-bromo-, diphenylsilylene ester?
The molecular weight of Benzoic acid, 4-bromo-, diphenylsilylene ester is 579.9341 g/mol.
Where can I buy Benzoic acid, 4-bromo-, diphenylsilylene ester?
You can request a quote for Benzoic acid, 4-bromo-, diphenylsilylene ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 4-bromo-, diphenylsilylene ester?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 4-bromo-, diphenylsilylene ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.