2-(4-甲氧基苯基)丁酸
TL;DR: 2-(4-甲氧基苯基)丁酸 (CAS 29644-99-3) is a chemical compound with molecular formula C11H14O3 and molecular weight 194.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-甲氧基苯基)丁酸
2-(4-methoxyphenyl)butanoic acid
Also Known As: 2-(4-methoxyphenyl)butanoic acid, 2- butanoicacid, p-methoxyphenylbutyric acid, 2-(p-Methoxyphenyl)butyric acid, 4-methoxyphenylbutanoic acid
| Molecular Formula | C11H14O3 |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 194.0943 |
| Heavy Atoms | 14 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 29644-99-3 |
|---|---|
| SMILES | CCC(C1=CC=C(C=C1)OC)C(=O)O |
| InChIKey | SHXBXUJGKPPUOS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-甲氧基苯基)丁酸 (CAS 29644-99-3), with molecular formula C11H14O3 and molecular weight 194.09 g/mol. IUPAC: 2-(4-methoxyphenyl)butanoic acid.
Chemical Property Profile of 2-(4-甲氧基苯基)丁酸
Property Insights of 2-(4-甲氧基苯基)丁酸
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-甲氧基苯基)丁酸. With a topological polar surface area (TPSA) of 46.5 Ų, 2-(4-甲氧基苯基)丁酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-甲氧基苯基)丁酸 has 1 hydrogen bond donor(s) and 3 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-(4-甲氧基苯基)丁酸?
The CAS number of 2-(4-甲氧基苯基)丁酸 is 29644-99-3.
What is the molecular formula of 2-(4-甲氧基苯基)丁酸?
The molecular formula of 2-(4-甲氧基苯基)丁酸 is C11H14O3.
What is the molecular weight of 2-(4-甲氧基苯基)丁酸?
The molecular weight of 2-(4-甲氧基苯基)丁酸 is 194.09 g/mol.
Where can I buy 2-(4-甲氧基苯基)丁酸?
You can request a quote for 2-(4-甲氧基苯基)丁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-甲氧基苯基)丁酸?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-甲氧基苯基)丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.