2,2-Diethoxyacetic acid
TL;DR: 2,2-Diethoxyacetic acid (CAS 20461-86-3) 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.
2,2-diethoxyacetic acid
Also Known As: 2,2-diethoxyacetic Acid, diethoxyacetic acid, Acetic acid, diethoxy-, 2,2-diethoxy acetic acid, J3.695.730A
| Molecular Formula | C6H12O4 |
|---|---|
| Molecular Weight | 148.07 g/mol |
| LogP | 0.4701 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 148.07356 |
| Heavy Atoms | 10 |
| Complexity | 95.92094 |
Chemical Identifiers
| CAS Number | 20461-86-3 |
|---|---|
| SMILES | CCOC(C(=O)O)OCC |
Product Overview
2,2-Diethoxyacetic acid (CAS 20461-86-3), with molecular formula C6H12O4 and molecular weight 148.07 g/mol. IUPAC: 2,2-diethoxyacetic acid.
Chemical Property Profile of 2,2-Diethoxyacetic acid
Property Insights of 2,2-Diethoxyacetic acid
The XLogP value of 0.4701 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Diethoxyacetic acid. With a topological polar surface area (TPSA) of 55.76 Ų, 2,2-Diethoxyacetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Diethoxyacetic acid 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 2,2-Diethoxyacetic acid?
The CAS number of 2,2-Diethoxyacetic acid is 20461-86-3.
What is the molecular formula of 2,2-Diethoxyacetic acid?
The molecular formula of 2,2-Diethoxyacetic acid is C6H12O4.
What is the molecular weight of 2,2-Diethoxyacetic acid?
The molecular weight of 2,2-Diethoxyacetic acid is 148.07 g/mol.
Where can I buy 2,2-Diethoxyacetic acid?
You can request a quote for 2,2-Diethoxyacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Diethoxyacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Diethoxyacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.