Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy-
TL;DR: Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy- (CAS 74706-17-5) is a chemical compound with molecular formula C17H15ClO2 and molecular weight 286.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-chloropent-4-ynoxy)-4-phenoxybenzene
Also Known As: NIOSH/SC4723000, Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy-, 1-(5-chloropent-4-ynoxy)-4-phenoxybenzene, 1-(4-Phenoxyphenoxy)-5-chloro-4-pentyne, 5-Chloro-1-(4-phenoxyphenoxy)-4-pentyne
| Molecular Formula | C17H15ClO2 |
|---|---|
| Molecular Weight | 286.08 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 286.07605 |
| Heavy Atoms | 20 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 74706-17-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=C(C=C2)OCCCC#CCl |
| InChIKey | OATQBIINLHCJON-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy- (CAS 74706-17-5), with molecular formula C17H15ClO2 and molecular weight 286.08 g/mol. IUPAC: 1-(5-chloropent-4-ynoxy)-4-phenoxybenzene.
Chemical Property Profile of Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy-
Property Insights of Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy-
The XLogP value of 5.3 indicates that Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy- 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 Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy-?
The CAS number of Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy- is 74706-17-5.
What is the molecular formula of Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy-?
The molecular formula of Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy- is C17H15ClO2.
What is the molecular weight of Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy-?
The molecular weight of Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy- is 286.08 g/mol.
Where can I buy Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy-?
You can request a quote for Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-((5-chloro-4-pentynyl)oxy)-4-phenoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.