Dimethyl perfluorosebacate
TL;DR: Dimethyl perfluorosebacate (CAS 4590-24-3) is a chemical compound with molecular formula C12H6F16O4 and molecular weight 518.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecanedioate
Also Known As: Dimethyl hexadecafluorosebacate, dimethyl perfluorosebacate, Dimethylperfluorosebacate, Dimethyl hexadecafluorosebacate,, Dimethyl perfluorodecanedioate
| Molecular Formula | C12H6F16O4 |
|---|---|
| Molecular Weight | 518.00 g/mol |
| LogP | 4.4148 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 518.00104 |
| Heavy Atoms | 32 |
| Complexity | 681.3008 |
Chemical Identifiers
| CAS Number | 4590-24-3 |
|---|---|
| SMILES | COC(=O)C(C(C(C(C(C(C(C(C(=O)OC)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
Product Overview
Dimethyl perfluorosebacate (CAS 4590-24-3), with molecular formula C12H6F16O4 and molecular weight 518.00 g/mol. IUPAC: dimethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorodecanedioate.
Chemical Property Profile of Dimethyl perfluorosebacate
Property Insights of Dimethyl perfluorosebacate
The XLogP value of 4.4148 indicates that Dimethyl perfluorosebacate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl perfluorosebacate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl perfluorosebacate 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 Dimethyl perfluorosebacate?
The CAS number of Dimethyl perfluorosebacate is 4590-24-3.
What is the molecular formula of Dimethyl perfluorosebacate?
The molecular formula of Dimethyl perfluorosebacate is C12H6F16O4.
What is the molecular weight of Dimethyl perfluorosebacate?
The molecular weight of Dimethyl perfluorosebacate is 518.00 g/mol.
Where can I buy Dimethyl perfluorosebacate?
You can request a quote for Dimethyl perfluorosebacate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl perfluorosebacate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl perfluorosebacate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.