Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro-
TL;DR: Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro- (CAS 87001-95-4) is a chemical compound with molecular formula C13H6ClF5O and molecular weight 308.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chlorophenoxy)methyl]-2,3,4,5,6-pentafluorobenzene
Also Known As: Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro-, 1-[(4-chlorophenoxy)methyl]-2,3,4,5,6-pentafluoro-benzene, 1-[(4-chlorophenoxy)methyl]-2,3,4,5,6-pentafluorobenzene
| Molecular Formula | C13H6ClF5O |
|---|---|
| Molecular Weight | 308.00 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.00275 |
| Heavy Atoms | 20 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 87001-95-4 |
|---|---|
| SMILES | C1=CC(=CC=C1OCC2=C(C(=C(C(=C2F)F)F)F)F)Cl |
| InChIKey | BFJYSTDWMGWNQP-UHFFFAOYSA-N |
Product Overview
Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro- (CAS 87001-95-4), with molecular formula C13H6ClF5O and molecular weight 308.00 g/mol. IUPAC: 1-[(4-chlorophenoxy)methyl]-2,3,4,5,6-pentafluorobenzene.
Chemical Property Profile of Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro-
Property Insights of Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro-
The XLogP value of 4.5 indicates that Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro- has 0 hydrogen bond donor(s) and 6 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 Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro-?
The CAS number of Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro- is 87001-95-4.
What is the molecular formula of Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro-?
The molecular formula of Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro- is C13H6ClF5O.
What is the molecular weight of Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro-?
The molecular weight of Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro- is 308.00 g/mol.
Where can I buy Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro-?
You can request a quote for Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-((4-chlorophenoxy)methyl)-2,3,4,5,6-pentafluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.