[2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate
TL;DR: [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate (CAS 72263-10-6) is a chemical compound with molecular formula C27H24O9S and molecular weight 524.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate
Also Known As: [2-benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate|4-Hydroxy-3-[(4-methylbenzene-1-sulfonyl)oxy]-6-oxocyclohexane-1,2-diyl dibenzoate
| Molecular Formula | C27H24O9S |
|---|---|
| Molecular Weight | 524.11 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 524.1141 |
| Heavy Atoms | 37 |
| Complexity | 907.0 |
Chemical Identifiers
| CAS Number | 72263-10-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2C(CC(=O)C(C2OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)O |
| InChIKey | ZZASBZSZVFGRIB-UHFFFAOYSA-N |
Product Overview
[2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate (CAS 72263-10-6), with molecular formula C27H24O9S and molecular weight 524.11 g/mol. IUPAC: [2-benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate.
Chemical Property Profile of [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate
Property Insights of [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate
The XLogP value of 3.8 indicates that [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.0 Ų indicates high polarity, suggesting [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate has 1 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 [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate?
The CAS number of [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate is 72263-10-6.
What is the molecular formula of [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate?
The molecular formula of [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate is C27H24O9S.
What is the molecular weight of [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate?
The molecular weight of [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate is 524.11 g/mol.
Where can I buy [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate?
You can request a quote for [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-Benzoyloxy-5-hydroxy-6-(4-methylphenyl)sulfonyloxy-3-oxocyclohexyl] benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.