![Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester structure](/static/products/5525/55255-98-6.webp)
Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester
TL;DR: Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester (CAS 55255-98-6) is a chemical compound with molecular formula C21H10F21NO6 and molecular weight 771.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-1-(2,2,3,3,4,4,4-heptafluorobutanoyloxy)ethyl]-2-methoxyphenyl] 2,2,3,3,4,4,4-heptafluorobutanoate
Also Known As: Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester, Heptafluorobutyricacid4-[2-[ amino]-1-[ oxy]ethyl]-2-methoxyphenylester, [4-[2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-1-(2,2,3,3,4,4,4-heptafluorobutanoyloxy)ethyl]-2-methoxyphenyl] 2,2,3,3,4,4,4-heptafluorobutanoate, [4-[2-(Perfluorobutanoyl)amino-1-(perfluorobutanoyloxy)ethyl]-2-methoxyphenyl] perfluorobutanoate, 2-(2,2,3,3,4,4,4-heptafluorobutanamido)-1-{4-[(2,2,3,3,4,4,4-heptafluorobutanoyl)oxy]-3-methoxyphenyl}ethyl 2,2,3,3,4,4,4-heptafluorobutanoate
| Molecular Formula | C21H10F21NO6 |
|---|---|
| Molecular Weight | 771.02 g/mol |
| LogP | 8.1 |
| Topological Polar Surface Area | 90.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 27 |
| Rotatable Bonds | 14 |
| Exact Mass | 771.0173 |
| Heavy Atoms | 49 |
| Complexity | 1210.0 |
Chemical Identifiers
| CAS Number | 55255-98-6 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(CNC(=O)C(C(C(F)(F)F)(F)F)(F)F)OC(=O)C(C(C(F)(F)F)(F)F)(F)F)OC(=O)C(C(C(F)(F)F)(F)F)(F)F |
| InChIKey | NGKDIDQUDSGVAQ-UHFFFAOYSA-N |
Product Overview
Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester (CAS 55255-98-6), with molecular formula C21H10F21NO6 and molecular weight 771.02 g/mol. IUPAC: [4-[2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-1-(2,2,3,3,4,4,4-heptafluorobutanoyloxy)ethyl]-2-methoxyphenyl] 2,2,3,3,4,4,4-heptafluorobutanoate.
Chemical Property Profile of Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester
Property Insights of Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester
The XLogP value of 8.1 indicates that Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester. Following Lipinski's Rule of Five, Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester has 1 hydrogen bond donor(s) and 27 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester?
The CAS number of Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester is 55255-98-6.
What is the molecular formula of Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester?
The molecular formula of Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester is C21H10F21NO6.
What is the molecular weight of Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester?
The molecular weight of Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester is 771.02 g/mol.
Where can I buy Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester?
You can request a quote for Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Butanoic acid, heptafluoro-, 4-[1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-2-methoxyphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.