Acetic acid, difluoroiodo-, 1-methylethyl ester
TL;DR: Acetic acid, difluoroiodo-, 1-methylethyl ester (CAS 127224-05-9) is a chemical compound with molecular formula C5H7F2IO2 and molecular weight 263.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2,2-difluoro-2-iodoacetate
Also Known As: isopropyl iododifluoroacetate, Acetic acid, difluoroiodo-, 1-methylethyl ester, propan-2-yl 2,2-difluoro-2-iodoacetate, Propan-2-yl difluoro(iodo)acetate, isopropyl 2,2-difluoro-2-iodoacetate
| Molecular Formula | C5H7F2IO2 |
|---|---|
| Molecular Weight | 263.95 g/mol |
| LogP | 1.9658 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 263.9459 |
| Heavy Atoms | 10 |
| Complexity | 130.09987 |
Chemical Identifiers
| CAS Number | 127224-05-9 |
|---|---|
| SMILES | CC(C)OC(=O)C(F)(F)I |
Product Overview
Acetic acid, difluoroiodo-, 1-methylethyl ester (CAS 127224-05-9), with molecular formula C5H7F2IO2 and molecular weight 263.95 g/mol. IUPAC: propan-2-yl 2,2-difluoro-2-iodoacetate.
Chemical Property Profile of Acetic acid, difluoroiodo-, 1-methylethyl ester
Property Insights of Acetic acid, difluoroiodo-, 1-methylethyl ester
The XLogP value of 1.9658 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, difluoroiodo-, 1-methylethyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Acetic acid, difluoroiodo-, 1-methylethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, difluoroiodo-, 1-methylethyl ester has 0 hydrogen bond donor(s) and 2 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 Acetic acid, difluoroiodo-, 1-methylethyl ester?
The CAS number of Acetic acid, difluoroiodo-, 1-methylethyl ester is 127224-05-9.
What is the molecular formula of Acetic acid, difluoroiodo-, 1-methylethyl ester?
The molecular formula of Acetic acid, difluoroiodo-, 1-methylethyl ester is C5H7F2IO2.
What is the molecular weight of Acetic acid, difluoroiodo-, 1-methylethyl ester?
The molecular weight of Acetic acid, difluoroiodo-, 1-methylethyl ester is 263.95 g/mol.
Where can I buy Acetic acid, difluoroiodo-, 1-methylethyl ester?
You can request a quote for Acetic acid, difluoroiodo-, 1-methylethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, difluoroiodo-, 1-methylethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, difluoroiodo-, 1-methylethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.