1-Propoxybutane
TL;DR: 1-Propoxybutane (CAS 3073-92-5) is a chemical compound with molecular formula C7H16O and molecular weight 116.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-propoxybutane
Also Known As: 1-Propoxybutane, Butane, 1-propoxy-, propylbutylether, Ether, butyl propyl, Butyl propyl ether
| Molecular Formula | C7H16O |
|---|---|
| Molecular Weight | 116.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 116.12012 |
| Heavy Atoms | 8 |
| Complexity | 35.0 |
Chemical Identifiers
| CAS Number | 3073-92-5 |
|---|---|
| SMILES | CCCCOCCC |
| InChIKey | YGZQJYIITOMTMD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propoxybutane (CAS 3073-92-5), with molecular formula C7H16O and molecular weight 116.12 g/mol. IUPAC: 1-propoxybutane.
Chemical Property Profile of 1-Propoxybutane
Property Insights of 1-Propoxybutane
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propoxybutane. With a topological polar surface area (TPSA) of 9.2 Ų, 1-Propoxybutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propoxybutane has 0 hydrogen bond donor(s) and 1 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-Propoxybutane?
The CAS number of 1-Propoxybutane is 3073-92-5.
What is the molecular formula of 1-Propoxybutane?
The molecular formula of 1-Propoxybutane is C7H16O.
What is the molecular weight of 1-Propoxybutane?
The molecular weight of 1-Propoxybutane is 116.12 g/mol.
Where can I buy 1-Propoxybutane?
You can request a quote for 1-Propoxybutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propoxybutane?
Yes, KEHONG BIO provides custom synthesis services for 1-Propoxybutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.