4-Benzoylphenyl cyclohexanecarboxylate
TL;DR: 4-Benzoylphenyl cyclohexanecarboxylate (CAS 112005-16-0) is a chemical compound with molecular formula C20H20O3 and molecular weight 308.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-benzoylphenyl) cyclohexanecarboxylate
Also Known As: 4-benzoylphenyl cyclohexanecarboxylate, 4-cyclohexanoyloxybenzophenone, (4-benzoylphenyl) cyclohexanecarboxylate, Cyclohexanecarboxylic acid 4-benzoyl-phenyl ester, AO-548/43179707
| Molecular Formula | C20H20O3 |
|---|---|
| Molecular Weight | 308.14 g/mol |
| LogP | 4.4033 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.14124 |
| Heavy Atoms | 23 |
| Complexity | 667.7928 |
Chemical Identifiers
| CAS Number | 112005-16-0 |
|---|---|
| SMILES | C1CCC(CC1)C(=O)OC2=CC=C(C=C2)C(=O)C3=CC=CC=C3 |
Product Overview
4-Benzoylphenyl cyclohexanecarboxylate (CAS 112005-16-0), with molecular formula C20H20O3 and molecular weight 308.14 g/mol. IUPAC: (4-benzoylphenyl) cyclohexanecarboxylate.
Chemical Property Profile of 4-Benzoylphenyl cyclohexanecarboxylate
Property Insights of 4-Benzoylphenyl cyclohexanecarboxylate
The XLogP value of 4.4033 indicates that 4-Benzoylphenyl cyclohexanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 4-Benzoylphenyl cyclohexanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzoylphenyl cyclohexanecarboxylate has 0 hydrogen bond donor(s) and 3 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 4-Benzoylphenyl cyclohexanecarboxylate?
The CAS number of 4-Benzoylphenyl cyclohexanecarboxylate is 112005-16-0.
What is the molecular formula of 4-Benzoylphenyl cyclohexanecarboxylate?
The molecular formula of 4-Benzoylphenyl cyclohexanecarboxylate is C20H20O3.
What is the molecular weight of 4-Benzoylphenyl cyclohexanecarboxylate?
The molecular weight of 4-Benzoylphenyl cyclohexanecarboxylate is 308.14 g/mol.
Where can I buy 4-Benzoylphenyl cyclohexanecarboxylate?
You can request a quote for 4-Benzoylphenyl cyclohexanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzoylphenyl cyclohexanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzoylphenyl cyclohexanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.