3-(1,1-Dimethylethoxy)-1-propanol
TL;DR: 3-(1,1-Dimethylethoxy)-1-propanol (CAS 80783-53-5) is a chemical compound with molecular formula C7H16O2 and molecular weight 132.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-methylpropan-2-yl)oxy]propan-1-ol
Also Known As: 3-tert-Butyloxy-1-propanol, 3-(TERT-BUTOXY)PROPAN-1-OL, 3-tert-butoxypropan-1-ol, 3-tert-butoxy-1-propanol, starbld0009328
| Molecular Formula | C7H16O2 |
|---|---|
| Molecular Weight | 132.12 g/mol |
| LogP | 1.1839 |
| Topological Polar Surface Area | 29.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 132.11504 |
| Heavy Atoms | 9 |
| Complexity | 63.80663 |
Chemical Identifiers
| CAS Number | 80783-53-5 |
|---|---|
| SMILES | CC(C)(C)OCCCO |
Product Overview
3-(1,1-Dimethylethoxy)-1-propanol (CAS 80783-53-5), with molecular formula C7H16O2 and molecular weight 132.12 g/mol. IUPAC: 3-[(2-methylpropan-2-yl)oxy]propan-1-ol.
Chemical Property Profile of 3-(1,1-Dimethylethoxy)-1-propanol
Property Insights of 3-(1,1-Dimethylethoxy)-1-propanol
The XLogP value of 1.1839 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,1-Dimethylethoxy)-1-propanol. With a topological polar surface area (TPSA) of 29.46 Ų, 3-(1,1-Dimethylethoxy)-1-propanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1,1-Dimethylethoxy)-1-propanol has 1 hydrogen bond donor(s) and 2 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 3-(1,1-Dimethylethoxy)-1-propanol?
The CAS number of 3-(1,1-Dimethylethoxy)-1-propanol is 80783-53-5.
What is the molecular formula of 3-(1,1-Dimethylethoxy)-1-propanol?
The molecular formula of 3-(1,1-Dimethylethoxy)-1-propanol is C7H16O2.
What is the molecular weight of 3-(1,1-Dimethylethoxy)-1-propanol?
The molecular weight of 3-(1,1-Dimethylethoxy)-1-propanol is 132.12 g/mol.
Where can I buy 3-(1,1-Dimethylethoxy)-1-propanol?
You can request a quote for 3-(1,1-Dimethylethoxy)-1-propanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,1-Dimethylethoxy)-1-propanol?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,1-Dimethylethoxy)-1-propanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.