1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate
TL;DR: 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate (CAS 24120-19-2) is a chemical compound with molecular formula C20H10F26O4 and molecular weight 808.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl) (E)-but-2-enedioate
Also Known As: Bis(1H,1H,2H,2H-perfluorooctyl)maleate, Bis[2-(perfluorohexyl)ethyl] fumarate, Bis(1H,1H,2H,2H-perfluorooctyl) maleate, 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate, Bis(1H,1H,2H,2H,-perfluorooctyl) (2Z)-but-2-ene-1,4-dioate
| Molecular Formula | C20H10F26O4 |
|---|---|
| Molecular Weight | 808.02 g/mol |
| LogP | 8.8868 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 808.0164 |
| Heavy Atoms | 50 |
| Complexity | 1148.7958 |
Chemical Identifiers
| CAS Number | 24120-19-2 |
|---|---|
| SMILES | C(COC(=O)/C=C/C(=O)OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
Product Overview
1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate (CAS 24120-19-2), with molecular formula C20H10F26O4 and molecular weight 808.02 g/mol. IUPAC: bis(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl) (E)-but-2-enedioate.
Chemical Property Profile of 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate
Property Insights of 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate
The XLogP value of 8.8868 indicates that 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate has 0 hydrogen bond donor(s) and 4 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(1H,1H,2H,2H-Perfluorooctyl) fumarate?
The CAS number of 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate is 24120-19-2.
What is the molecular formula of 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate?
The molecular formula of 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate is C20H10F26O4.
What is the molecular weight of 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate?
The molecular weight of 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate is 808.02 g/mol.
Where can I buy 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate?
You can request a quote for 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate 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(1H,1H,2H,2H-Perfluorooctyl) fumarate?
Yes, KEHONG BIO provides custom synthesis services for 1,4-bis(1H,1H,2H,2H-Perfluorooctyl) fumarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.