1,1'-Oxybis-3-buten-2-OL
TL;DR: 1,1'-Oxybis-3-buten-2-OL (CAS 83682-67-1) is a chemical compound with molecular formula C8H14O3 and molecular weight 158.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-hydroxybut-3-enoxy)but-3-en-2-ol
Also Known As: 1,1'-OXYBIS-3-BUTEN-2-OL, 1,1'-Oxydi(but-3-en-2-ol), 1,1 -Oxybis(3-butene-2-ol), 1-(2-hydroxybut-3-enoxy)but-3-en-2-ol, J1.596.189I
| Molecular Formula | C8H14O3 |
|---|---|
| Molecular Weight | 158.09 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 158.0943 |
| Heavy Atoms | 11 |
| Complexity | 109.0 |
Chemical Identifiers
| CAS Number | 83682-67-1 |
|---|---|
| SMILES | C=CC(COCC(C=C)O)O |
| InChIKey | SKIOXONYFXKRIC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1'-Oxybis-3-buten-2-OL (CAS 83682-67-1), with molecular formula C8H14O3 and molecular weight 158.09 g/mol. IUPAC: 1-(2-hydroxybut-3-enoxy)but-3-en-2-ol.
Chemical Property Profile of 1,1'-Oxybis-3-buten-2-OL
Property Insights of 1,1'-Oxybis-3-buten-2-OL
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-Oxybis-3-buten-2-OL. With a topological polar surface area (TPSA) of 49.7 Ų, 1,1'-Oxybis-3-buten-2-OL exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-Oxybis-3-buten-2-OL 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 1,1'-Oxybis-3-buten-2-OL?
The CAS number of 1,1'-Oxybis-3-buten-2-OL is 83682-67-1.
What is the molecular formula of 1,1'-Oxybis-3-buten-2-OL?
The molecular formula of 1,1'-Oxybis-3-buten-2-OL is C8H14O3.
What is the molecular weight of 1,1'-Oxybis-3-buten-2-OL?
The molecular weight of 1,1'-Oxybis-3-buten-2-OL is 158.09 g/mol.
Where can I buy 1,1'-Oxybis-3-buten-2-OL?
You can request a quote for 1,1'-Oxybis-3-buten-2-OL directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-Oxybis-3-buten-2-OL?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Oxybis-3-buten-2-OL and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.