1-Tert-butoxy-3-ethoxy-2-propanol
TL;DR: 1-Tert-butoxy-3-ethoxy-2-propanol (CAS 42910-64-5) is a chemical compound with molecular formula C9H20O3 and molecular weight 176.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethoxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
Also Known As: 1-Tert-butoxy-3-ethoxy-2-propanol, 1-tert-Butoxy-3-ethoxypropan-2-ol, 1-ethoxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
| Molecular Formula | C9H20O3 |
|---|---|
| Molecular Weight | 176.14 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 176.14125 |
| Heavy Atoms | 12 |
| Complexity | 107.0 |
Chemical Identifiers
| CAS Number | 42910-64-5 |
|---|---|
| SMILES | CCOCC(COC(C)(C)C)O |
| InChIKey | MRRMNHYRTIBHOF-UHFFFAOYSA-N |
Product Overview
1-Tert-butoxy-3-ethoxy-2-propanol (CAS 42910-64-5), with molecular formula C9H20O3 and molecular weight 176.14 g/mol. IUPAC: 1-ethoxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol.
Chemical Property Profile of 1-Tert-butoxy-3-ethoxy-2-propanol
Property Insights of 1-Tert-butoxy-3-ethoxy-2-propanol
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Tert-butoxy-3-ethoxy-2-propanol. With a topological polar surface area (TPSA) of 38.7 Ų, 1-Tert-butoxy-3-ethoxy-2-propanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Tert-butoxy-3-ethoxy-2-propanol 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 1-Tert-butoxy-3-ethoxy-2-propanol?
The CAS number of 1-Tert-butoxy-3-ethoxy-2-propanol is 42910-64-5.
What is the molecular formula of 1-Tert-butoxy-3-ethoxy-2-propanol?
The molecular formula of 1-Tert-butoxy-3-ethoxy-2-propanol is C9H20O3.
What is the molecular weight of 1-Tert-butoxy-3-ethoxy-2-propanol?
The molecular weight of 1-Tert-butoxy-3-ethoxy-2-propanol is 176.14 g/mol.
Where can I buy 1-Tert-butoxy-3-ethoxy-2-propanol?
You can request a quote for 1-Tert-butoxy-3-ethoxy-2-propanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Tert-butoxy-3-ethoxy-2-propanol?
Yes, KEHONG BIO provides custom synthesis services for 1-Tert-butoxy-3-ethoxy-2-propanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.