![1-[4-(2-Methylpropyl)phenyl]ethyl acetate structure](/static/products/1389/138948-58-0.webp)
1-[4-(2-Methylpropyl)phenyl]ethyl acetate
TL;DR: 1-[4-(2-Methylpropyl)phenyl]ethyl acetate (CAS 138948-58-0) is a chemical compound with molecular formula C14H20O2 and molecular weight 220.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(2-methylpropyl)phenyl]ethyl acetate
Also Known As: 1-(4-Isobutylphenyl)ethyl acetate, 1-[4-(2-methylpropyl)phenyl]ethyl acetate, 1-(4-Isobutylphenyl)ethyl acetate #, Benzenemethanol, -alpha--methyl-4-(2-methylpropyl)-, acetate (9CI), Benzenemethanol, .alpha.-methyl-4-(2-methylpropyl)-, acetate
| Molecular Formula | C14H20O2 |
|---|---|
| Molecular Weight | 220.15 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 220.14633 |
| Heavy Atoms | 16 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 138948-58-0 |
|---|---|
| SMILES | CC(C)CC1=CC=C(C=C1)C(C)OC(=O)C |
| InChIKey | XJQCNYKZEMUABS-UHFFFAOYSA-N |
Product Overview
1-[4-(2-Methylpropyl)phenyl]ethyl acetate (CAS 138948-58-0), with molecular formula C14H20O2 and molecular weight 220.15 g/mol. IUPAC: 1-[4-(2-methylpropyl)phenyl]ethyl acetate.
Chemical Property Profile of 1-[4-(2-Methylpropyl)phenyl]ethyl acetate
Property Insights of 1-[4-(2-Methylpropyl)phenyl]ethyl acetate
The XLogP value of 3.6 indicates that 1-[4-(2-Methylpropyl)phenyl]ethyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 1-[4-(2-Methylpropyl)phenyl]ethyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(2-Methylpropyl)phenyl]ethyl acetate has 0 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 1-[4-(2-Methylpropyl)phenyl]ethyl acetate?
The CAS number of 1-[4-(2-Methylpropyl)phenyl]ethyl acetate is 138948-58-0.
What is the molecular formula of 1-[4-(2-Methylpropyl)phenyl]ethyl acetate?
The molecular formula of 1-[4-(2-Methylpropyl)phenyl]ethyl acetate is C14H20O2.
What is the molecular weight of 1-[4-(2-Methylpropyl)phenyl]ethyl acetate?
The molecular weight of 1-[4-(2-Methylpropyl)phenyl]ethyl acetate is 220.15 g/mol.
Where can I buy 1-[4-(2-Methylpropyl)phenyl]ethyl acetate?
You can request a quote for 1-[4-(2-Methylpropyl)phenyl]ethyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(2-Methylpropyl)phenyl]ethyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(2-Methylpropyl)phenyl]ethyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.