![Butyl 2-[4-(2-methylpropyl)phenyl]propanoate structure](/static/products/646/64622-49-7.png)
Butyl 2-[4-(2-methylpropyl)phenyl]propanoate
TL;DR: Butyl 2-[4-(2-methylpropyl)phenyl]propanoate (CAS 64622-49-7) is a chemical compound with molecular formula C17H26O2 and molecular weight 262.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-[4-(2-methylpropyl)phenyl]propanoate
Also Known As: Ibuprofen butyl, Ibuprofen, butyl ester, butyl 2-(4-isobutylphenyl)propanoate, Butyl 2-[4-(2-methylpropyl)phenyl]propanoate, 2-(4-Isobutylphenyl)propanoic acid butyl ester
| Molecular Formula | C17H26O2 |
|---|---|
| Molecular Weight | 262.19 g/mol |
| LogP | 4.3319 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 262.19327 |
| Heavy Atoms | 19 |
| Complexity | 378.75348 |
Chemical Identifiers
| CAS Number | 64622-49-7 |
|---|---|
| SMILES | CCCCOC(=O)C(C)C1=CC=C(C=C1)CC(C)C |
Product Overview
Butyl 2-[4-(2-methylpropyl)phenyl]propanoate (CAS 64622-49-7), with molecular formula C17H26O2 and molecular weight 262.19 g/mol. IUPAC: butyl 2-[4-(2-methylpropyl)phenyl]propanoate.
Chemical Property Profile of Butyl 2-[4-(2-methylpropyl)phenyl]propanoate
Property Insights of Butyl 2-[4-(2-methylpropyl)phenyl]propanoate
The XLogP value of 4.3319 indicates that Butyl 2-[4-(2-methylpropyl)phenyl]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Butyl 2-[4-(2-methylpropyl)phenyl]propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl 2-[4-(2-methylpropyl)phenyl]propanoate 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 Butyl 2-[4-(2-methylpropyl)phenyl]propanoate?
The CAS number of Butyl 2-[4-(2-methylpropyl)phenyl]propanoate is 64622-49-7.
What is the molecular formula of Butyl 2-[4-(2-methylpropyl)phenyl]propanoate?
The molecular formula of Butyl 2-[4-(2-methylpropyl)phenyl]propanoate is C17H26O2.
What is the molecular weight of Butyl 2-[4-(2-methylpropyl)phenyl]propanoate?
The molecular weight of Butyl 2-[4-(2-methylpropyl)phenyl]propanoate is 262.19 g/mol.
Where can I buy Butyl 2-[4-(2-methylpropyl)phenyl]propanoate?
You can request a quote for Butyl 2-[4-(2-methylpropyl)phenyl]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 2-[4-(2-methylpropyl)phenyl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 2-[4-(2-methylpropyl)phenyl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.