Glycol monobutyl ether acetate
TL;DR: Glycol monobutyl ether acetate (CAS 112-07-2) is a chemical compound with molecular formula C8H16O3 and molecular weight 160.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butoxyethyl acetate
Also Known As: 2-Butoxyethyl acetate, Butoxyethyl acetate, Butyl glycol acetate, Butylglycol acetate, Butyl cellosolve acetate
| Molecular Formula | C8H16O3 |
|---|---|
| Molecular Weight | 160.11 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 160.10994 |
| Heavy Atoms | 11 |
| Complexity | 102.0 |
| Melting Point | -63.5 °C |
| Boiling Point | 192.2 °C at 760 mmHg |
| Density | 0.942 at 20.0 °C - Less dense than water; will float |
| Solubility | 1.5 % (NIOSH, 2024) |
| Flash Point | 71.1 °C |
| Vapor Pressure | 0.3 mmHg |
| Refractive Index | 1.4200 at 20 °C |
Chemical Identifiers
| CAS Number | 112-07-2 |
|---|---|
| SMILES | CCCCOCCOC(=O)C |
| InChIKey | NQBXSWAWVZHKBZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Glycol monobutyl ether acetate (CAS 112-07-2), with molecular formula C8H16O3 and molecular weight 160.11 g/mol. IUPAC: 2-butoxyethyl acetate.
Chemical Property Profile of Glycol monobutyl ether acetate
Property Insights of Glycol monobutyl ether acetate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Glycol monobutyl ether acetate. With a topological polar surface area (TPSA) of 35.5 Ų, Glycol monobutyl ether acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Glycol monobutyl ether acetate has 0 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 Glycol monobutyl ether acetate?
The CAS number of Glycol monobutyl ether acetate is 112-07-2.
What is the molecular formula of Glycol monobutyl ether acetate?
The molecular formula of Glycol monobutyl ether acetate is C8H16O3.
What is the molecular weight of Glycol monobutyl ether acetate?
The molecular weight of Glycol monobutyl ether acetate is 160.11 g/mol.
Where can I buy Glycol monobutyl ether acetate?
You can request a quote for Glycol monobutyl ether acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glycol monobutyl ether acetate?
Yes, KEHONG BIO provides custom synthesis services for Glycol monobutyl ether acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.