1,4-Bis(pentachlorophenyl)-1,4-butanedione
TL;DR: 1,4-Bis(pentachlorophenyl)-1,4-butanedione (CAS 19349-32-7) is a chemical compound with molecular formula C16H4Cl10O2 and molecular weight 577.71 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-bis(2,3,4,5,6-pentachlorophenyl)butane-1,4-dione
Also Known As: 1,4-BIS(PENTACHLOROPHENYL)-1,4-BUTANEDIONE, 1,4-bis(2,3,4,5,6-pentachlorophenyl)butane-1,4-dione
| Molecular Formula | C16H4Cl10O2 |
|---|---|
| Molecular Weight | 577.71 g/mol |
| LogP | 10.0664 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 577.70966 |
| Heavy Atoms | 28 |
| Complexity | 875.9504 |
Chemical Identifiers
| CAS Number | 19349-32-7 |
|---|---|
| SMILES | C(CC(=O)C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)C(=O)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl |
Product Overview
1,4-Bis(pentachlorophenyl)-1,4-butanedione (CAS 19349-32-7), with molecular formula C16H4Cl10O2 and molecular weight 577.71 g/mol. IUPAC: 1,4-bis(2,3,4,5,6-pentachlorophenyl)butane-1,4-dione.
Chemical Property Profile of 1,4-Bis(pentachlorophenyl)-1,4-butanedione
Property Insights of 1,4-Bis(pentachlorophenyl)-1,4-butanedione
The XLogP value of 10.0664 indicates that 1,4-Bis(pentachlorophenyl)-1,4-butanedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 1,4-Bis(pentachlorophenyl)-1,4-butanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Bis(pentachlorophenyl)-1,4-butanedione 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 1,4-Bis(pentachlorophenyl)-1,4-butanedione?
The CAS number of 1,4-Bis(pentachlorophenyl)-1,4-butanedione is 19349-32-7.
What is the molecular formula of 1,4-Bis(pentachlorophenyl)-1,4-butanedione?
The molecular formula of 1,4-Bis(pentachlorophenyl)-1,4-butanedione is C16H4Cl10O2.
What is the molecular weight of 1,4-Bis(pentachlorophenyl)-1,4-butanedione?
The molecular weight of 1,4-Bis(pentachlorophenyl)-1,4-butanedione is 577.71 g/mol.
Where can I buy 1,4-Bis(pentachlorophenyl)-1,4-butanedione?
You can request a quote for 1,4-Bis(pentachlorophenyl)-1,4-butanedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bis(pentachlorophenyl)-1,4-butanedione?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis(pentachlorophenyl)-1,4-butanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.