4-Bromophenyl 4-tert-butylcyclohexanecarboxylate
TL;DR: 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate (CAS 313967-08-7) is a chemical compound with molecular formula C17H23BrO2 and molecular weight 338.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl) 4-tert-butylcyclohexane-1-carboxylate
Also Known As: 4-bromophenyl 4-tert-butylcyclohexanecarboxylate, 4-BROMOPHENYL 4-TERT-BUTYLCYCLOHEXANE-1-CARBOXYLATE, (4-bromophenyl) 4-tert-butylcyclohexane-1-carboxylate
| Molecular Formula | C17H23BrO2 |
|---|---|
| Molecular Weight | 338.09 g/mol |
| LogP | 5.207 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 338.08813 |
| Heavy Atoms | 20 |
| Complexity | 450.8735 |
Chemical Identifiers
| CAS Number | 313967-08-7 |
|---|---|
| SMILES | CC(C)(C)C1CCC(CC1)C(=O)OC2=CC=C(C=C2)Br |
Product Overview
4-Bromophenyl 4-tert-butylcyclohexanecarboxylate (CAS 313967-08-7), with molecular formula C17H23BrO2 and molecular weight 338.09 g/mol. IUPAC: (4-bromophenyl) 4-tert-butylcyclohexane-1-carboxylate.
Chemical Property Profile of 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate
Property Insights of 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate
The XLogP value of 5.207 indicates that 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate 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-Bromophenyl 4-tert-butylcyclohexanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate 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-Bromophenyl 4-tert-butylcyclohexanecarboxylate?
The CAS number of 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate is 313967-08-7.
What is the molecular formula of 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate?
The molecular formula of 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate is C17H23BrO2.
What is the molecular weight of 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate?
The molecular weight of 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate is 338.09 g/mol.
Where can I buy 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate?
You can request a quote for 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromophenyl 4-tert-butylcyclohexanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.