7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol
TL;DR: 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol (CAS 7231-46-1) is a chemical compound with molecular formula C29H28F6O4 and molecular weight 554.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11,12-dimethoxy-8,15-bis(trifluoromethyl)tetracyclo[15.2.2.23,6.210,13]pentacosa-1(19),3(25),4,6(24),10,12,17,20,22-nonaene-8,15-diol
Also Known As: 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol
| Molecular Formula | C29H28F6O4 |
|---|---|
| Molecular Weight | 554.19 g/mol |
| LogP | 5.7652 |
| Topological Polar Surface Area | 58.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 554.18915 |
| Heavy Atoms | 39 |
| Complexity | 1201.0836 |
Chemical Identifiers
| CAS Number | 7231-46-1 |
|---|---|
| SMILES | COC1=C2CC(CC3=CC=C(CC4=CC=C(CC(CC(=C1OC)C=C2)(C(F)(F)F)O)C=C4)C=C3)(C(F)(F)F)O |
Product Overview
7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol (CAS 7231-46-1), with molecular formula C29H28F6O4 and molecular weight 554.19 g/mol. IUPAC: 11,12-dimethoxy-8,15-bis(trifluoromethyl)tetracyclo[15.2.2.23,6.210,13]pentacosa-1(19),3(25),4,6(24),10,12,17,20,22-nonaene-8,15-diol.
Chemical Property Profile of 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol
Property Insights of 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol
The XLogP value of 5.7652 indicates that 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.92 Ų, 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol?
The CAS number of 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol is 7231-46-1.
What is the molecular formula of 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol?
The molecular formula of 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol is C29H28F6O4.
What is the molecular weight of 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol?
The molecular weight of 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol is 554.19 g/mol.
Where can I buy 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol?
You can request a quote for 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol?
Yes, KEHONG BIO provides custom synthesis services for 7~2~,7~3~-Dimethoxy-5,9-bis(trifluoromethyl)-1,3,7(1,4)-tribenzenacyclodecaphane-5,9-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.