2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)-
TL;DR: 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)- (CAS 29372-69-8) is a chemical compound with molecular formula C17H8Cl2O and molecular weight 298.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-bis(4-chlorophenyl)penta-2,4-diyn-1-one
Also Known As: 1,5-Bis -2,4-pentadiyn-1-one, 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)-, bis(4-chlorophenyl)penta-2,4-diyn-1-one, 1,5-bis(4-chlorophenyl)penta-2,4-diyn-1-one, 1,5-Bis(4-chlorophenyl)-2,4-pentadiyn-1-one
| Molecular Formula | C17H8Cl2O |
|---|---|
| Molecular Weight | 298.00 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.9952 |
| Heavy Atoms | 20 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 29372-69-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C#CC#CC(=O)C2=CC=C(C=C2)Cl)Cl |
| InChIKey | UKLOTQZKJCRNGI-UHFFFAOYSA-N |
Product Overview
2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)- (CAS 29372-69-8), with molecular formula C17H8Cl2O and molecular weight 298.00 g/mol. IUPAC: 1,5-bis(4-chlorophenyl)penta-2,4-diyn-1-one.
Chemical Property Profile of 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)-
Property Insights of 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)-
The XLogP value of 5.5 indicates that 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)- 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 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)-?
The CAS number of 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)- is 29372-69-8.
What is the molecular formula of 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)-?
The molecular formula of 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)- is C17H8Cl2O.
What is the molecular weight of 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)-?
The molecular weight of 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)- is 298.00 g/mol.
Where can I buy 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)-?
You can request a quote for 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Pentadiyn-1-one, 1,5-bis(4-chlorophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.