1-Butanol, 3-(3-hydroxybutoxy)-
TL;DR: 1-Butanol, 3-(3-hydroxybutoxy)- (CAS 65849-81-2) 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-(4-hydroxybutan-2-yloxy)butan-2-ol
Also Known As: 1-Butanol, 3-(3-hydroxybutoxy)-, 3-(3-hydroxybutoxy)-1-butanol, 3-(3-Hydroxybutoxy)butan-1-ol, 3- butan-1-ol, 4-(4-hydroxybutan-2-yloxy)butan-2-ol
| 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 | 85.0 |
Chemical Identifiers
| CAS Number | 65849-81-2 |
|---|---|
| SMILES | CC(CCOC(C)CCO)O |
| InChIKey | HNXKBOZFEUCZHF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Butanol, 3-(3-hydroxybutoxy)- (CAS 65849-81-2), with molecular formula C8H18O3 and molecular weight 162.13 g/mol. IUPAC: 4-(4-hydroxybutan-2-yloxy)butan-2-ol.
Chemical Property Profile of 1-Butanol, 3-(3-hydroxybutoxy)-
Property Insights of 1-Butanol, 3-(3-hydroxybutoxy)-
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butanol, 3-(3-hydroxybutoxy)-. With a topological polar surface area (TPSA) of 49.7 Ų, 1-Butanol, 3-(3-hydroxybutoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butanol, 3-(3-hydroxybutoxy)- 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-Butanol, 3-(3-hydroxybutoxy)-?
The CAS number of 1-Butanol, 3-(3-hydroxybutoxy)- is 65849-81-2.
What is the molecular formula of 1-Butanol, 3-(3-hydroxybutoxy)-?
The molecular formula of 1-Butanol, 3-(3-hydroxybutoxy)- is C8H18O3.
What is the molecular weight of 1-Butanol, 3-(3-hydroxybutoxy)-?
The molecular weight of 1-Butanol, 3-(3-hydroxybutoxy)- is 162.13 g/mol.
Where can I buy 1-Butanol, 3-(3-hydroxybutoxy)-?
You can request a quote for 1-Butanol, 3-(3-hydroxybutoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butanol, 3-(3-hydroxybutoxy)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Butanol, 3-(3-hydroxybutoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.