![2-[(4-cyanophenoxy)methyl]benzoic Acid structure](/static/products/866/866156-20-9.png)
2-[(4-cyanophenoxy)methyl]benzoic Acid
TL;DR: 2-[(4-cyanophenoxy)methyl]benzoic Acid (CAS 866156-20-9) is a chemical compound with molecular formula C15H11NO3 and molecular weight 253.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-cyanophenoxy)methyl]benzoic acid
Also Known As: 2-[(4-cyanophenoxy)methyl]benzoic Acid, 2-(4-cyanophenoxymethyl)benzoic acid, 2-[(4-cyanophenoxy)methyl]benzoicAcid, 2-((4-Cyanophenoxy)methyl)benzoic acid, 2-[(4-cyanophenoxy)methyl]benzenecarboxylic acid
| Molecular Formula | C15H11NO3 |
|---|---|
| Molecular Weight | 253.07 g/mol |
| LogP | 2.83548 |
| Topological Polar Surface Area | 70.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.0739 |
| Heavy Atoms | 19 |
| Complexity | 626.5841 |
Chemical Identifiers
| CAS Number | 866156-20-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)COC2=CC=C(C=C2)C#N)C(=O)O |
Product Overview
2-[(4-cyanophenoxy)methyl]benzoic Acid (CAS 866156-20-9), with molecular formula C15H11NO3 and molecular weight 253.07 g/mol. IUPAC: 2-[(4-cyanophenoxy)methyl]benzoic acid.
Chemical Property Profile of 2-[(4-cyanophenoxy)methyl]benzoic Acid
Property Insights of 2-[(4-cyanophenoxy)methyl]benzoic Acid
The XLogP value of 2.83548 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-cyanophenoxy)methyl]benzoic Acid. The TPSA of 70.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-cyanophenoxy)methyl]benzoic Acid. Following Lipinski's Rule of Five, 2-[(4-cyanophenoxy)methyl]benzoic Acid 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-cyanophenoxy)methyl]benzoic Acid?
The CAS number of 2-[(4-cyanophenoxy)methyl]benzoic Acid is 866156-20-9.
What is the molecular formula of 2-[(4-cyanophenoxy)methyl]benzoic Acid?
The molecular formula of 2-[(4-cyanophenoxy)methyl]benzoic Acid is C15H11NO3.
What is the molecular weight of 2-[(4-cyanophenoxy)methyl]benzoic Acid?
The molecular weight of 2-[(4-cyanophenoxy)methyl]benzoic Acid is 253.07 g/mol.
Where can I buy 2-[(4-cyanophenoxy)methyl]benzoic Acid?
You can request a quote for 2-[(4-cyanophenoxy)methyl]benzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-cyanophenoxy)methyl]benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-cyanophenoxy)methyl]benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.