![2-[4-(3-Oxobutyl)phenoxy]ethyl acetate structure](/static/products/928/92864-95-4.png)
2-[4-(3-Oxobutyl)phenoxy]ethyl acetate
TL;DR: 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate (CAS 92864-95-4) is a chemical compound with molecular formula C14H18O4 and molecular weight 250.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3-oxobutyl)phenoxy]ethyl acetate
Also Known As: 2-[4-(3-oxobutyl)phenoxy]ethyl acetate
| Molecular Formula | C14H18O4 |
|---|---|
| Molecular Weight | 250.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 250.12051 |
| Heavy Atoms | 18 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 92864-95-4 |
|---|---|
| SMILES | CC(=O)CCC1=CC=C(C=C1)OCCOC(=O)C |
| InChIKey | OISLPKPRUREZGH-UHFFFAOYSA-N |
Product Overview
2-[4-(3-Oxobutyl)phenoxy]ethyl acetate (CAS 92864-95-4), with molecular formula C14H18O4 and molecular weight 250.12 g/mol. IUPAC: 2-[4-(3-oxobutyl)phenoxy]ethyl acetate.
Chemical Property Profile of 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate
Property Insights of 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate. With a topological polar surface area (TPSA) of 52.6 Ų, 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate has 0 hydrogen bond donor(s) and 4 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 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate?
The CAS number of 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate is 92864-95-4.
What is the molecular formula of 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate?
The molecular formula of 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate is C14H18O4.
What is the molecular weight of 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate?
The molecular weight of 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate is 250.12 g/mol.
Where can I buy 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate?
You can request a quote for 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(3-Oxobutyl)phenoxy]ethyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.