Iodomethyl pivalate
TL;DR: Iodomethyl pivalate (CAS 53064-79-2) is a chemical compound with molecular formula C6H11IO2 and molecular weight 241.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
iodomethyl 2,2-dimethylpropanoate
Also Known As: Iodomethyl pivalate, iodomethyl 2,2-dimethylpropanoate, iodomethylpivalate, pivaloyloxymethyl iodide, POMI
| Molecular Formula | C6H11IO2 |
|---|---|
| Molecular Weight | 241.98 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.98038 |
| Heavy Atoms | 9 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 53064-79-2 |
|---|---|
| SMILES | CC(C)(C)C(=O)OCI |
| InChIKey | PELJISAVHGXLAL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Iodomethyl pivalate (CAS 53064-79-2), with molecular formula C6H11IO2 and molecular weight 241.98 g/mol. IUPAC: iodomethyl 2,2-dimethylpropanoate.
Chemical Property Profile of Iodomethyl pivalate
Property Insights of Iodomethyl pivalate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Iodomethyl pivalate. With a topological polar surface area (TPSA) of 26.3 Ų, Iodomethyl pivalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Iodomethyl pivalate 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 Iodomethyl pivalate?
The CAS number of Iodomethyl pivalate is 53064-79-2.
What is the molecular formula of Iodomethyl pivalate?
The molecular formula of Iodomethyl pivalate is C6H11IO2.
What is the molecular weight of Iodomethyl pivalate?
The molecular weight of Iodomethyl pivalate is 241.98 g/mol.
Where can I buy Iodomethyl pivalate?
You can request a quote for Iodomethyl pivalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Iodomethyl pivalate?
Yes, KEHONG BIO provides custom synthesis services for Iodomethyl pivalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.