1-Butoxy-3-(2-butoxyethoxy)propan-2-ol
TL;DR: 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol (CAS 113850-31-0) is a chemical compound with molecular formula C13H28O4 and molecular weight 248.19876 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-butoxy-3-(2-butoxyethoxy)propan-2-ol
Also Known As: 1-butoxy-3-(2-butoxyethoxy)propan-2-ol, 2-Propanol, 1-butoxy-3-(2-butoxyethoxy)-, 2-Propanol,1-butoxy-3-(2-butoxyethoxy)
Technical Specifications
| Molecular Formula | C13H28O4 |
| Molecular Weight | 248.19876 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 47.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 248.19876 Da |
| Heavy Atoms | 17 |
| Complexity | 141.0 |
| SMILES | CCCCOCCOCC(COCCCC)O |
| InChIKey | HUZWPRPCAGDZDF-UHFFFAOYSA-N |
Chemical Property Profile of 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol
Property Insights of 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol. With a topological polar surface area (TPSA) of 47.9 Ų, 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol 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
What is the CAS number of 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol?
The CAS number of 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol is 113850-31-0.
What is the molecular formula of 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol?
The molecular formula of 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol is C13H28O4.
What is the molecular weight of 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol?
The molecular weight of 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol is 248.19876 g/mol.
Where can I buy 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol?
You can request a quote for 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol?
Yes, CoreyChem provides custom synthesis services for 1-Butoxy-3-(2-butoxyethoxy)propan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.