4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid
TL;DR: 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid (CAS 4705-97-9) is a chemical compound with molecular formula C13H18O3 and molecular weight 222.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methoxy-2,5-dimethylphenyl)butanoic acid
Also Known As: 4-(4-methoxy-2,5-dimethylphenyl)butanoic acid, 4-(4-Methoxy-2,5-dimethyl-phenyl)-butyric acid, BAS 13318132, 4-(4-methoxy-2,5-dimethylphenyl)butanoicacid, 4-(4-Methoxy-2,5-dimethyl-phenyl)-buttersaeure
| Molecular Formula | C13H18O3 |
|---|---|
| Molecular Weight | 222.13 g/mol |
| LogP | 2.71934 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 222.1256 |
| Heavy Atoms | 16 |
| Complexity | 383.00925 |
Chemical Identifiers
| CAS Number | 4705-97-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1OC)C)CCCC(=O)O |
Product Overview
4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid (CAS 4705-97-9), with molecular formula C13H18O3 and molecular weight 222.13 g/mol. IUPAC: 4-(4-methoxy-2,5-dimethylphenyl)butanoic acid.
Chemical Property Profile of 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid
Property Insights of 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid
The XLogP value of 2.71934 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid. With a topological polar surface area (TPSA) of 46.53 Ų, 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Methoxy-2,5-dimethylphenyl)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 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid?
The CAS number of 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid is 4705-97-9.
What is the molecular formula of 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid?
The molecular formula of 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid is C13H18O3.
What is the molecular weight of 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid?
The molecular weight of 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid is 222.13 g/mol.
Where can I buy 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid?
You can request a quote for 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methoxy-2,5-dimethylphenyl)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.