Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)-
TL;DR: Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)- (CAS 1777-56-6) is a chemical compound with molecular formula C26H20ClOP and molecular weight 414.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-2-(triphenyl-λ5-phosphanylidene)ethanone
Also Known As: KST-1B1058, 1-(4-chlorophenyl)-2-(triphenyl-, 4-Chlorophenacylidenetriphenylphosphorane, Triphenylphosphine-p-chlorobenzoylmethylene, 4-Chlorobenzoylmethylenetriphenylphosphorane
| Molecular Formula | C26H20ClOP |
|---|---|
| Molecular Weight | 414.09 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.09402 |
| Heavy Atoms | 29 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 1777-56-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)P(=CC(=O)C2=CC=C(C=C2)Cl)(C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | DBIGDAIVQGYSSM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)- (CAS 1777-56-6), with molecular formula C26H20ClOP and molecular weight 414.09 g/mol. IUPAC: 1-(4-chlorophenyl)-2-(triphenyl-λ5-phosphanylidene)ethanone.
Chemical Property Profile of Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)-
Property Insights of Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)-
The XLogP value of 5.9 indicates that Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)-?
The CAS number of Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)- is 1777-56-6.
What is the molecular formula of Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)-?
The molecular formula of Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)- is C26H20ClOP.
What is the molecular weight of Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)-?
The molecular weight of Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)- is 414.09 g/mol.
Where can I buy Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)-?
You can request a quote for Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(4-chlorophenyl)-2-(triphenylphosphinylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.