Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester
TL;DR: Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester (CAS 377-71-9) is a chemical compound with molecular formula C8H10F4O4 and molecular weight 246.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2,2,3,3-tetrafluorobutanedioate
Also Known As: Diethyl tetrafluorosuccinate, Diethyl perfluorosuccinate, Diethyl 2,2,3,3-tetrafluorosuccinate, Ethyl perfluorosuccinate, diethyl 2,2,3,3-tetrafluorobutanedioate
| Molecular Formula | C8H10F4O4 |
|---|---|
| Molecular Weight | 246.05 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 246.05153 |
| Heavy Atoms | 16 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 377-71-9 |
|---|---|
| SMILES | CCOC(=O)C(C(C(=O)OCC)(F)F)(F)F |
| InChIKey | BLZSSBPZHBFNBN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester (CAS 377-71-9), with molecular formula C8H10F4O4 and molecular weight 246.05 g/mol. IUPAC: diethyl 2,2,3,3-tetrafluorobutanedioate.
Chemical Property Profile of Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester
Property Insights of Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester. With a topological polar surface area (TPSA) of 52.6 Ų, Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester has 0 hydrogen bond donor(s) and 8 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 Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester?
The CAS number of Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester is 377-71-9.
What is the molecular formula of Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester?
The molecular formula of Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester is C8H10F4O4.
What is the molecular weight of Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester?
The molecular weight of Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester is 246.05 g/mol.
Where can I buy Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester?
You can request a quote for Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.