![Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate structure](/static/products/302/302589-49-7.png)
Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate
TL;DR: Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate (CAS 302589-49-7) is a chemical compound with molecular formula C33H30O6 and molecular weight 522.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate
Also Known As: methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate, methyl 4-(bis(2,6-dioxo-4-phenylcyclohexyl)methyl)benzoate, Methyl 4-[bis(2,6-dioxo-4-phenyl-cyclohexyl)methyl]benzoate
| Molecular Formula | C33H30O6 |
|---|---|
| Molecular Weight | 522.20 g/mol |
| LogP | 5.2208 |
| Topological Polar Surface Area | 94.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 522.2042 |
| Heavy Atoms | 39 |
| Complexity | 1277.6263 |
Chemical Identifiers
| CAS Number | 302589-49-7 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C(C2C(=O)CC(CC2=O)C3=CC=CC=C3)C4C(=O)CC(CC4=O)C5=CC=CC=C5 |
Product Overview
Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate (CAS 302589-49-7), with molecular formula C33H30O6 and molecular weight 522.20 g/mol. IUPAC: methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate.
Chemical Property Profile of Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate
Property Insights of Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate
The XLogP value of 5.2208 indicates that Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.58 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate. Following Lipinski's Rule of Five, Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate 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 Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate?
The CAS number of Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate is 302589-49-7.
What is the molecular formula of Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate?
The molecular formula of Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate is C33H30O6.
What is the molecular weight of Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate?
The molecular weight of Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate is 522.20 g/mol.
Where can I buy Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate?
You can request a quote for Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[bis(2,6-dioxo-4-phenylcyclohexyl)methyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.