3-(phenoxymethyl)benzoic Acid
TL;DR: 3-(phenoxymethyl)benzoic Acid (CAS 31719-75-2) is a chemical compound with molecular formula C14H12O3 and molecular weight 228.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(phenoxymethyl)benzoic acid
Also Known As: 3-(phenoxymethyl)benzoic Acid, 3- benzoicacid, 3-Phenoxymethyl-benzoesaeure, 3-(PHENOXYMETHYL)BENZOICACID, Benzoic acid,3-(phenoxymethyl)-
| Molecular Formula | C14H12O3 |
|---|---|
| Molecular Weight | 228.08 g/mol |
| LogP | 2.9638 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.07864 |
| Heavy Atoms | 17 |
| Complexity | 505.8856 |
Chemical Identifiers
| CAS Number | 31719-75-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCC2=CC(=CC=C2)C(=O)O |
Product Overview
3-(phenoxymethyl)benzoic Acid (CAS 31719-75-2), with molecular formula C14H12O3 and molecular weight 228.08 g/mol. IUPAC: 3-(phenoxymethyl)benzoic acid.
Chemical Property Profile of 3-(phenoxymethyl)benzoic Acid
Property Insights of 3-(phenoxymethyl)benzoic Acid
The XLogP value of 2.9638 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(phenoxymethyl)benzoic Acid. With a topological polar surface area (TPSA) of 46.53 Ų, 3-(phenoxymethyl)benzoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(phenoxymethyl)benzoic 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-(phenoxymethyl)benzoic Acid?
The CAS number of 3-(phenoxymethyl)benzoic Acid is 31719-75-2.
What is the molecular formula of 3-(phenoxymethyl)benzoic Acid?
The molecular formula of 3-(phenoxymethyl)benzoic Acid is C14H12O3.
What is the molecular weight of 3-(phenoxymethyl)benzoic Acid?
The molecular weight of 3-(phenoxymethyl)benzoic Acid is 228.08 g/mol.
Where can I buy 3-(phenoxymethyl)benzoic Acid?
You can request a quote for 3-(phenoxymethyl)benzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(phenoxymethyl)benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(phenoxymethyl)benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.