3,3'-Oxybis-2-butanol
TL;DR: 3,3'-Oxybis-2-butanol (CAS 62897-92-1) 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.
3-(3-hydroxybutan-2-yloxy)butan-2-ol
Also Known As: 3,3'-oxybis-2-butanol, 2-Butanol, 3,3'-oxybis-, 3,3'-oxydi-2-butanol, 2-Butanol,3,3'-oxydi, 3-(3-hydroxybutan-2-yloxy)butan-2-ol
| Molecular Formula | C8H18O3 |
|---|---|
| Molecular Weight | 162.13 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 162.1256 |
| Heavy Atoms | 11 |
| Complexity | 93.0 |
Chemical Identifiers
| CAS Number | 62897-92-1 |
|---|---|
| SMILES | CC(C(C)OC(C)C(C)O)O |
| InChIKey | GWHZXOQHXAXFQK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3'-Oxybis-2-butanol (CAS 62897-92-1), with molecular formula C8H18O3 and molecular weight 162.13 g/mol. IUPAC: 3-(3-hydroxybutan-2-yloxy)butan-2-ol.
Chemical Property Profile of 3,3'-Oxybis-2-butanol
Property Insights of 3,3'-Oxybis-2-butanol
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3'-Oxybis-2-butanol. With a topological polar surface area (TPSA) of 49.7 Ų, 3,3'-Oxybis-2-butanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3'-Oxybis-2-butanol 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'-Oxybis-2-butanol?
The CAS number of 3,3'-Oxybis-2-butanol is 62897-92-1.
What is the molecular formula of 3,3'-Oxybis-2-butanol?
The molecular formula of 3,3'-Oxybis-2-butanol is C8H18O3.
What is the molecular weight of 3,3'-Oxybis-2-butanol?
The molecular weight of 3,3'-Oxybis-2-butanol is 162.13 g/mol.
Where can I buy 3,3'-Oxybis-2-butanol?
You can request a quote for 3,3'-Oxybis-2-butanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Oxybis-2-butanol?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Oxybis-2-butanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.