1,4-Dichlorohexafluoro-2-butene
TL;DR: 1,4-Dichlorohexafluoro-2-butene (CAS 20972-44-5) is a chemical compound with molecular formula C4Cl2F6 and molecular weight 231.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1,4-dichloro-1,1,2,3,4,4-hexafluorobut-2-ene
Also Known As: 1,4-Dichlorohexafluoro-2-butene, C4Cl2F6, 1,4-dichlorohexafluoro--2--butene, 1609AE, (2E)-1,4-Dichloro-hexafluoro-2-butene
| Molecular Formula | C4Cl2F6 |
|---|---|
| Molecular Weight | 231.93 g/mol |
| LogP | 3.8002 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.92813 |
| Heavy Atoms | 12 |
| Complexity | 176.57408 |
Chemical Identifiers
| CAS Number | 20972-44-5 |
|---|---|
| SMILES | C(=C(/C(F)(F)Cl)\F)(\C(F)(F)Cl)/F |
Product Overview
1,4-Dichlorohexafluoro-2-butene (CAS 20972-44-5), with molecular formula C4Cl2F6 and molecular weight 231.93 g/mol. IUPAC: (E)-1,4-dichloro-1,1,2,3,4,4-hexafluorobut-2-ene.
Chemical Property Profile of 1,4-Dichlorohexafluoro-2-butene
Property Insights of 1,4-Dichlorohexafluoro-2-butene
The XLogP value of 3.8002 indicates that 1,4-Dichlorohexafluoro-2-butene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,4-Dichlorohexafluoro-2-butene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dichlorohexafluoro-2-butene has 0 hydrogen bond donor(s) and 0 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 1,4-Dichlorohexafluoro-2-butene?
The CAS number of 1,4-Dichlorohexafluoro-2-butene is 20972-44-5.
What is the molecular formula of 1,4-Dichlorohexafluoro-2-butene?
The molecular formula of 1,4-Dichlorohexafluoro-2-butene is C4Cl2F6.
What is the molecular weight of 1,4-Dichlorohexafluoro-2-butene?
The molecular weight of 1,4-Dichlorohexafluoro-2-butene is 231.93 g/mol.
Where can I buy 1,4-Dichlorohexafluoro-2-butene?
You can request a quote for 1,4-Dichlorohexafluoro-2-butene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dichlorohexafluoro-2-butene?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dichlorohexafluoro-2-butene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.