1,3-Diethoxy-2,2-bis(ethoxymethyl)propane
TL;DR: 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane (CAS 757-45-9) is a chemical compound with molecular formula C13H28O4 and molecular weight 248.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diethoxy-2,2-bis(ethoxymethyl)propane
Also Known As: 1,3-diethoxy-2,2-bis(ethoxymethyl)propane, pentaerythritol ethoxylate, Pentaerythrittetraethylether, Tetrakis(ethoxymethyl)methane, tetra-O-ethyl-pentaerythritol
| Molecular Formula | C13H28O4 |
|---|---|
| Molecular Weight | 248.20 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 248.19876 |
| Heavy Atoms | 17 |
| Complexity | 124.0 |
Chemical Identifiers
| CAS Number | 757-45-9 |
|---|---|
| SMILES | CCOCC(COCC)(COCC)COCC |
| InChIKey | IUMWCGQVPDIISH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Diethoxy-2,2-bis(ethoxymethyl)propane (CAS 757-45-9), with molecular formula C13H28O4 and molecular weight 248.20 g/mol. IUPAC: 1,3-diethoxy-2,2-bis(ethoxymethyl)propane.
Chemical Property Profile of 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane
Property Insights of 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane. With a topological polar surface area (TPSA) of 36.9 Ų, 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane 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 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane?
The CAS number of 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane is 757-45-9.
What is the molecular formula of 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane?
The molecular formula of 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane is C13H28O4.
What is the molecular weight of 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane?
The molecular weight of 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane is 248.20 g/mol.
Where can I buy 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane?
You can request a quote for 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Diethoxy-2,2-bis(ethoxymethyl)propane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.