4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate
TL;DR: 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate (CAS 79912-98-4) is a chemical compound with molecular formula C24H29FO2 and molecular weight 368.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-fluorophenyl) 4-(4-pentylcyclohexyl)benzoate
Also Known As: 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate, 4-Fluoro-Phenyl-4'-Trans-PentylcyclohexylBenzoate, (4-fluorophenyl) 4-(4-pentylcyclohexyl)benzoate, 4-fluorophenyl 4-(4-pentylcyclohexyl)benzoate, BAS 01123575
| Molecular Formula | C24H29FO2 |
|---|---|
| Molecular Weight | 368.22 g/mol |
| LogP | 6.899 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 368.21515 |
| Heavy Atoms | 27 |
| Complexity | 713.05133 |
Chemical Identifiers
| CAS Number | 79912-98-4 |
|---|---|
| SMILES | CCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)F |
Product Overview
4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate (CAS 79912-98-4), with molecular formula C24H29FO2 and molecular weight 368.22 g/mol. IUPAC: (4-fluorophenyl) 4-(4-pentylcyclohexyl)benzoate.
Chemical Property Profile of 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate
Property Insights of 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate
The XLogP value of 6.899 indicates that 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate?
The CAS number of 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate is 79912-98-4.
What is the molecular formula of 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate?
The molecular formula of 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate is C24H29FO2.
What is the molecular weight of 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate?
The molecular weight of 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate is 368.22 g/mol.
Where can I buy 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate?
You can request a quote for 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluorophenyl 4-(trans-4-pentylcyclohexyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.