4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol
TL;DR: 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol (CAS 329701-38-4) is a chemical compound with molecular formula C18H8Cl2F6N2O3 and molecular weight 483.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-bis[4-chloro-3-(trifluoromethyl)phenoxy]-1H-pyrimidin-2-one
Also Known As: 4,6-bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol, 4,6-bis[4-chloro-3-(trifluoromethyl)phenoxy]-1H-pyrimidin-2-one, 4,6-Bis(4-chloro-3-(trifluoromethyl)phenoxy)pyrimidin-2-ol, 4,6-bis[4-chloro-3-(trifluoromethyl)phenoxy]-2-pyrimidinol
| Molecular Formula | C18H8Cl2F6N2O3 |
|---|---|
| Molecular Weight | 483.98 g/mol |
| LogP | 6.6989 |
| Topological Polar Surface Area | 64.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 483.98163 |
| Heavy Atoms | 31 |
| Complexity | 1091.4274 |
Chemical Identifiers
| CAS Number | 329701-38-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1OC2=CC(=NC(=O)N2)OC3=CC(=C(C=C3)Cl)C(F)(F)F)C(F)(F)F)Cl |
Product Overview
4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol (CAS 329701-38-4), with molecular formula C18H8Cl2F6N2O3 and molecular weight 483.98 g/mol. IUPAC: 4,6-bis[4-chloro-3-(trifluoromethyl)phenoxy]-1H-pyrimidin-2-one.
Chemical Property Profile of 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol
Property Insights of 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol
The XLogP value of 6.6989 indicates that 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol. Following Lipinski's Rule of Five, 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol has 1 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 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol?
The CAS number of 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol is 329701-38-4.
What is the molecular formula of 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol?
The molecular formula of 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol is C18H8Cl2F6N2O3.
What is the molecular weight of 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol?
The molecular weight of 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol is 483.98 g/mol.
Where can I buy 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol?
You can request a quote for 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Bis[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidin-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.