Propylene glycol propyl ether
TL;DR: Propylene glycol propyl ether (CAS 4161-22-2) is a chemical compound with molecular formula C6H14O2 and molecular weight 118.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-propoxypropan-1-ol
Also Known As: 3-propoxypropan-1-ol, Propoxypropanol, Propasol P, 1-Propanol, 3-propoxy-, n-Propoxypropanol
| Molecular Formula | C6H14O2 |
|---|---|
| Molecular Weight | 118.10 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 118.09938 |
| Heavy Atoms | 8 |
| Complexity | 37.0 |
| Melting Point | -80.0 °C |
| Boiling Point | 149.8 °C at 760 mmHg |
| Density | 0.8865 at 20.0 °C - Less dense than water; will float |
| Flash Point | 53.3 °C |
Chemical Identifiers
| CAS Number | 4161-22-2 |
|---|---|
| SMILES | CCCOCCCO |
| InChIKey | LDMRLRNXHLPZJN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propylene glycol propyl ether (CAS 4161-22-2), with molecular formula C6H14O2 and molecular weight 118.10 g/mol. IUPAC: 3-propoxypropan-1-ol.
Chemical Property Profile of Propylene glycol propyl ether
Property Insights of Propylene glycol propyl ether
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propylene glycol propyl ether. With a topological polar surface area (TPSA) of 29.5 Ų, Propylene glycol propyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propylene glycol propyl ether has 1 hydrogen bond donor(s) and 2 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 Propylene glycol propyl ether?
The CAS number of Propylene glycol propyl ether is 4161-22-2.
What is the molecular formula of Propylene glycol propyl ether?
The molecular formula of Propylene glycol propyl ether is C6H14O2.
What is the molecular weight of Propylene glycol propyl ether?
The molecular weight of Propylene glycol propyl ether is 118.10 g/mol.
Where can I buy Propylene glycol propyl ether?
You can request a quote for Propylene glycol propyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propylene glycol propyl ether?
Yes, KEHONG BIO provides custom synthesis services for Propylene glycol propyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.