3,3'-Dihydroxydibutyl ether
TL;DR: 3,3'-Dihydroxydibutyl ether (CAS 821-33-0) is a chemical compound with molecular formula C8H18O3 and molecular weight 162.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-hydroxybutoxy)butan-2-ol
Also Known As: Dyskinebyl, colenormol, Diskin, Discinil, oxydibutanol
| Molecular Formula | C8H18O3 |
|---|---|
| Molecular Weight | 162.13 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 162.1256 |
| Heavy Atoms | 11 |
| Complexity | 75.0 |
Chemical Identifiers
| CAS Number | 821-33-0 |
|---|---|
| SMILES | CC(CCOCCC(C)O)O |
| InChIKey | AFSYRVDDZGJTIL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3'-Dihydroxydibutyl ether (CAS 821-33-0), with molecular formula C8H18O3 and molecular weight 162.13 g/mol. IUPAC: 4-(3-hydroxybutoxy)butan-2-ol.
Chemical Property Profile of 3,3'-Dihydroxydibutyl ether
Property Insights of 3,3'-Dihydroxydibutyl ether
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3'-Dihydroxydibutyl ether. With a topological polar surface area (TPSA) of 49.7 Ų, 3,3'-Dihydroxydibutyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3'-Dihydroxydibutyl ether has 2 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 3,3'-Dihydroxydibutyl ether?
The CAS number of 3,3'-Dihydroxydibutyl ether is 821-33-0.
What is the molecular formula of 3,3'-Dihydroxydibutyl ether?
The molecular formula of 3,3'-Dihydroxydibutyl ether is C8H18O3.
What is the molecular weight of 3,3'-Dihydroxydibutyl ether?
The molecular weight of 3,3'-Dihydroxydibutyl ether is 162.13 g/mol.
Where can I buy 3,3'-Dihydroxydibutyl ether?
You can request a quote for 3,3'-Dihydroxydibutyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Dihydroxydibutyl ether?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Dihydroxydibutyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.