![3-[4-(3-methylbutyl)phenyl]butanoic Acid structure](/static/products/6518/65189-79-9.webp)
3-[4-(3-methylbutyl)phenyl]butanoic Acid
TL;DR: 3-[4-(3-methylbutyl)phenyl]butanoic Acid (CAS 65189-79-9) is a chemical compound with molecular formula C15H22O2 and molecular weight 234.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(3-methylbutyl)phenyl]butanoic acid
Also Known As: 3-[4-(3-methylbutyl)phenyl]butanoic Acid, 3-(4-ISOPENTYLPHENYL)BUTANOIC ACID, Benzenepropanoic acid, beta-methyl-4-(3-methylbutyl)-
| Molecular Formula | C15H22O2 |
|---|---|
| Molecular Weight | 234.16 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 234.16199 |
| Heavy Atoms | 17 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 65189-79-9 |
|---|---|
| SMILES | CC(C)CCC1=CC=C(C=C1)C(C)CC(=O)O |
| InChIKey | ANHVCHYRRRCGAF-UHFFFAOYSA-N |
Product Overview
3-[4-(3-methylbutyl)phenyl]butanoic Acid (CAS 65189-79-9), with molecular formula C15H22O2 and molecular weight 234.16 g/mol. IUPAC: 3-[4-(3-methylbutyl)phenyl]butanoic acid.
Chemical Property Profile of 3-[4-(3-methylbutyl)phenyl]butanoic Acid
Property Insights of 3-[4-(3-methylbutyl)phenyl]butanoic Acid
The XLogP value of 4.3 indicates that 3-[4-(3-methylbutyl)phenyl]butanoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3-[4-(3-methylbutyl)phenyl]butanoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[4-(3-methylbutyl)phenyl]butanoic Acid 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 3-[4-(3-methylbutyl)phenyl]butanoic Acid?
The CAS number of 3-[4-(3-methylbutyl)phenyl]butanoic Acid is 65189-79-9.
What is the molecular formula of 3-[4-(3-methylbutyl)phenyl]butanoic Acid?
The molecular formula of 3-[4-(3-methylbutyl)phenyl]butanoic Acid is C15H22O2.
What is the molecular weight of 3-[4-(3-methylbutyl)phenyl]butanoic Acid?
The molecular weight of 3-[4-(3-methylbutyl)phenyl]butanoic Acid is 234.16 g/mol.
Where can I buy 3-[4-(3-methylbutyl)phenyl]butanoic Acid?
You can request a quote for 3-[4-(3-methylbutyl)phenyl]butanoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(3-methylbutyl)phenyl]butanoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(3-methylbutyl)phenyl]butanoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.