(Bromomethanetriyl)tri(4,1-phenylene) tribenzoate
TL;DR: (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate (CAS 86610-66-4) is a chemical compound with molecular formula C40H27BrO6 and molecular weight 682.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[bis(4-benzoyloxyphenyl)-bromomethyl]phenyl] benzoate
Also Known As: 4,4',4''-Tris(benzoyloxy)trityl bromide, Thallium(i)sulfide, (Bromomethanetriyl)tris(benzene-4,1-diyl) tribenzoate, Tris(4-benzoyloxyphenyl)methyl bromide, 4,4',4''-TRIS TRITYLBROMIDE
| Molecular Formula | C40H27BrO6 |
|---|---|
| Molecular Weight | 682.10 g/mol |
| LogP | 9.031 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 682.0991 |
| Heavy Atoms | 47 |
| Complexity | 1742.0098 |
Chemical Identifiers
| CAS Number | 86610-66-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)(C5=CC=C(C=C5)OC(=O)C6=CC=CC=C6)Br |
Product Overview
(Bromomethanetriyl)tri(4,1-phenylene) tribenzoate (CAS 86610-66-4), with molecular formula C40H27BrO6 and molecular weight 682.10 g/mol. IUPAC: [4-[bis(4-benzoyloxyphenyl)-bromomethyl]phenyl] benzoate.
Chemical Property Profile of (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate
Property Insights of (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate
The XLogP value of 9.031 indicates that (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate. Following Lipinski's Rule of Five, (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate?
The CAS number of (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate is 86610-66-4.
What is the molecular formula of (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate?
The molecular formula of (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate is C40H27BrO6.
What is the molecular weight of (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate?
The molecular weight of (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate is 682.10 g/mol.
Where can I buy (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate?
You can request a quote for (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate?
Yes, KEHONG BIO provides custom synthesis services for (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.