Methyl 3,3-dimethoxypropionate
TL;DR: Methyl 3,3-dimethoxypropionate (CAS 7424-91-1) is a chemical compound with molecular formula C6H12O4 and molecular weight 148.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,3-dimethoxypropanoate
Also Known As: Methyl 3,3-dimethoxypropionate, Methyl 3,3-dimethoxypropanoate, zlchem 282, methyl3,3-dimethoxypropionate, Methyl3,3-dimethoxypropanoate
| Molecular Formula | C6H12O4 |
|---|---|
| Molecular Weight | 148.07 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 148.07356 |
| Heavy Atoms | 10 |
| Complexity | 97.0 |
Chemical Identifiers
| CAS Number | 7424-91-1 |
|---|---|
| SMILES | COC(CC(=O)OC)OC |
| InChIKey | SMCVPMKCDDNUCQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 3,3-dimethoxypropionate (CAS 7424-91-1), with molecular formula C6H12O4 and molecular weight 148.07 g/mol. IUPAC: methyl 3,3-dimethoxypropanoate.
Chemical Property Profile of Methyl 3,3-dimethoxypropionate
Property Insights of Methyl 3,3-dimethoxypropionate
The XLogP value of -0.1 indicates that Methyl 3,3-dimethoxypropionate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 44.8 Ų, Methyl 3,3-dimethoxypropionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3,3-dimethoxypropionate has 0 hydrogen bond donor(s) and 4 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 Methyl 3,3-dimethoxypropionate?
The CAS number of Methyl 3,3-dimethoxypropionate is 7424-91-1.
What is the molecular formula of Methyl 3,3-dimethoxypropionate?
The molecular formula of Methyl 3,3-dimethoxypropionate is C6H12O4.
What is the molecular weight of Methyl 3,3-dimethoxypropionate?
The molecular weight of Methyl 3,3-dimethoxypropionate is 148.07 g/mol.
Where can I buy Methyl 3,3-dimethoxypropionate?
You can request a quote for Methyl 3,3-dimethoxypropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3,3-dimethoxypropionate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3,3-dimethoxypropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.