1-(tert-Butyldioxy)-3-propoxy-2-propanol
TL;DR: 1-(tert-Butyldioxy)-3-propoxy-2-propanol (CAS 38578-22-2) is a chemical compound with molecular formula C10H22O4 and molecular weight 206.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butylperoxy-3-propoxypropan-2-ol
Also Known As: 1- -3-propoxy-2-propanol, 1-(tert-Butyldioxy)-3-propoxy-2-propanol, 1-(tert-Bbutyldioxy)-3-propoxy-2-propanol, 1-tert-butylperoxy-3-propoxypropan-2-ol, 1-propoxy-3-tert-butylperoxy-propan-2-ol
| Molecular Formula | C10H22O4 |
|---|---|
| Molecular Weight | 206.15 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 206.15181 |
| Heavy Atoms | 14 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 38578-22-2 |
|---|---|
| SMILES | CCCOCC(COOC(C)(C)C)O |
| InChIKey | KLSFNXMIRGINHI-UHFFFAOYSA-N |
Product Overview
1-(tert-Butyldioxy)-3-propoxy-2-propanol (CAS 38578-22-2), with molecular formula C10H22O4 and molecular weight 206.15 g/mol. IUPAC: 1-tert-butylperoxy-3-propoxypropan-2-ol.
Chemical Property Profile of 1-(tert-Butyldioxy)-3-propoxy-2-propanol
Property Insights of 1-(tert-Butyldioxy)-3-propoxy-2-propanol
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(tert-Butyldioxy)-3-propoxy-2-propanol. With a topological polar surface area (TPSA) of 47.9 Ų, 1-(tert-Butyldioxy)-3-propoxy-2-propanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(tert-Butyldioxy)-3-propoxy-2-propanol has 1 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-(tert-Butyldioxy)-3-propoxy-2-propanol?
The CAS number of 1-(tert-Butyldioxy)-3-propoxy-2-propanol is 38578-22-2.
What is the molecular formula of 1-(tert-Butyldioxy)-3-propoxy-2-propanol?
The molecular formula of 1-(tert-Butyldioxy)-3-propoxy-2-propanol is C10H22O4.
What is the molecular weight of 1-(tert-Butyldioxy)-3-propoxy-2-propanol?
The molecular weight of 1-(tert-Butyldioxy)-3-propoxy-2-propanol is 206.15 g/mol.
Where can I buy 1-(tert-Butyldioxy)-3-propoxy-2-propanol?
You can request a quote for 1-(tert-Butyldioxy)-3-propoxy-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-Butyldioxy)-3-propoxy-2-propanol?
Yes, KEHONG BIO provides custom synthesis services for 1-(tert-Butyldioxy)-3-propoxy-2-propanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.