2-(3,4-Dimethylphenoxy)butanoic acid
TL;DR: 2-(3,4-Dimethylphenoxy)butanoic acid (CAS 25140-78-7) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethylphenoxy)butanoic acid
Also Known As: 2-(3,4-dimethylphenoxy)butanoic acid, 2-(3,4-Dimethyl-phenoxy)-butyric acid, Butanoic acid, 2-(3,4-dimethylphenoxy)-, BAS 13532075, Butanoic acid,2-(3,4-dimethylphenoxy)-
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 2.54544 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 357.88492 |
Chemical Identifiers
| CAS Number | 25140-78-7 |
|---|---|
| SMILES | CCC(C(=O)O)OC1=CC(=C(C=C1)C)C |
Product Overview
2-(3,4-Dimethylphenoxy)butanoic acid (CAS 25140-78-7), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: 2-(3,4-dimethylphenoxy)butanoic acid.
Chemical Property Profile of 2-(3,4-Dimethylphenoxy)butanoic acid
Property Insights of 2-(3,4-Dimethylphenoxy)butanoic acid
The XLogP value of 2.54544 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-Dimethylphenoxy)butanoic acid. With a topological polar surface area (TPSA) of 46.53 Ų, 2-(3,4-Dimethylphenoxy)butanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-Dimethylphenoxy)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 2-(3,4-Dimethylphenoxy)butanoic acid?
The CAS number of 2-(3,4-Dimethylphenoxy)butanoic acid is 25140-78-7.
What is the molecular formula of 2-(3,4-Dimethylphenoxy)butanoic acid?
The molecular formula of 2-(3,4-Dimethylphenoxy)butanoic acid is C12H16O3.
What is the molecular weight of 2-(3,4-Dimethylphenoxy)butanoic acid?
The molecular weight of 2-(3,4-Dimethylphenoxy)butanoic acid is 208.11 g/mol.
Where can I buy 2-(3,4-Dimethylphenoxy)butanoic acid?
You can request a quote for 2-(3,4-Dimethylphenoxy)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dimethylphenoxy)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethylphenoxy)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.