3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate
TL;DR: 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate (CAS 16083-75-3) is a chemical compound with molecular formula C13H9F15O3 and molecular weight 498.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,4,5,5,6,6,7,7,8,9,9,9-dodecafluoro-2-hydroxy-8-(trifluoromethyl)nonyl] prop-2-enoate
Also Known As: 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate, 2-Hydroxy-3-[perfluoro(5-methylhex-1-yl)]propyl acrylate, K-5040, 2-iodo-3-(perfluoro-5-methylhexyl)propan-1-ol, 3-(perfluoro-5-methylhexyl)-2-hydroxypropyl acrylate
| Molecular Formula | C13H9F15O3 |
|---|---|
| Molecular Weight | 498.03 g/mol |
| LogP | 4.8407 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 498.03122 |
| Heavy Atoms | 31 |
| Complexity | 650.046 |
Chemical Identifiers
| CAS Number | 16083-75-3 |
|---|---|
| SMILES | C=CC(=O)OCC(CC(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)O |
Product Overview
3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate (CAS 16083-75-3), with molecular formula C13H9F15O3 and molecular weight 498.03 g/mol. IUPAC: [4,4,5,5,6,6,7,7,8,9,9,9-dodecafluoro-2-hydroxy-8-(trifluoromethyl)nonyl] prop-2-enoate.
Chemical Property Profile of 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate
Property Insights of 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate
The XLogP value of 4.8407 indicates that 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate has 1 hydrogen bond donor(s) and 3 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 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate?
The CAS number of 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate is 16083-75-3.
What is the molecular formula of 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate?
The molecular formula of 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate is C13H9F15O3.
What is the molecular weight of 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate?
The molecular weight of 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate is 498.03 g/mol.
Where can I buy 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate?
You can request a quote for 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate?
Yes, KEHONG BIO provides custom synthesis services for 3-(Perfluoro-5-methylhexyl)-2-hydroxypropylacrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.