Propylene glycol isobutyl ether
TL;DR: Propylene glycol isobutyl ether (CAS 89855-49-2) is a chemical compound with molecular formula C7H16O2 and molecular weight 132.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylpropoxy)propan-1-ol
Also Known As: Isobutoxypropanol, 3-(2-methylpropoxy)propan-1-ol, 3-isobutoxypropan-1-ol, Ucon LB-65, Ucon LB-135
| Molecular Formula | C7H16O2 |
|---|---|
| Molecular Weight | 132.12 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 132.11504 |
| Heavy Atoms | 9 |
| Complexity | 52.0 |
Chemical Identifiers
| CAS Number | 89855-49-2 |
|---|---|
| SMILES | CC(C)COCCCO |
| InChIKey | BUIXEGYUDCDLCD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propylene glycol isobutyl ether (CAS 89855-49-2), with molecular formula C7H16O2 and molecular weight 132.12 g/mol. IUPAC: 3-(2-methylpropoxy)propan-1-ol.
Chemical Property Profile of Propylene glycol isobutyl ether
Property Insights of Propylene glycol isobutyl ether
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propylene glycol isobutyl ether. With a topological polar surface area (TPSA) of 29.5 Ų, Propylene glycol isobutyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propylene glycol isobutyl 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 isobutyl ether?
The CAS number of Propylene glycol isobutyl ether is 89855-49-2.
What is the molecular formula of Propylene glycol isobutyl ether?
The molecular formula of Propylene glycol isobutyl ether is C7H16O2.
What is the molecular weight of Propylene glycol isobutyl ether?
The molecular weight of Propylene glycol isobutyl ether is 132.12 g/mol.
Where can I buy Propylene glycol isobutyl ether?
You can request a quote for Propylene glycol isobutyl 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 isobutyl ether?
Yes, KEHONG BIO provides custom synthesis services for Propylene glycol isobutyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.