3-(4-Formylphenyl)benzoic acid
TL;DR: 3-(4-Formylphenyl)benzoic acid (CAS 222180-20-3) is a chemical compound with molecular formula C14H10O3 and molecular weight 226.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-formylphenyl)benzoic acid
Also Known As: 4'-Formylbiphenyl-3-carboxylic acid, 3-(4-Formylphenyl)benzoic acid, 4'-Formyl-[1,1'-biphenyl]-3-carboxylic acid, 4'-Formyl-biphenyl-3-carboxylic acid, AMTDA116
| Molecular Formula | C14H10O3 |
|---|---|
| Molecular Weight | 226.06 g/mol |
| LogP | 2.8643 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.06299 |
| Heavy Atoms | 17 |
| Complexity | 555.93494 |
Chemical Identifiers
| CAS Number | 222180-20-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(=O)O)C2=CC=C(C=C2)C=O |
Product Overview
3-(4-Formylphenyl)benzoic acid (CAS 222180-20-3), with molecular formula C14H10O3 and molecular weight 226.06 g/mol. IUPAC: 3-(4-formylphenyl)benzoic acid.
Chemical Property Profile of 3-(4-Formylphenyl)benzoic acid
Property Insights of 3-(4-Formylphenyl)benzoic acid
The XLogP value of 2.8643 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Formylphenyl)benzoic acid. With a topological polar surface area (TPSA) of 54.37 Ų, 3-(4-Formylphenyl)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Formylphenyl)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-(4-Formylphenyl)benzoic acid?
The CAS number of 3-(4-Formylphenyl)benzoic acid is 222180-20-3.
What is the molecular formula of 3-(4-Formylphenyl)benzoic acid?
The molecular formula of 3-(4-Formylphenyl)benzoic acid is C14H10O3.
What is the molecular weight of 3-(4-Formylphenyl)benzoic acid?
The molecular weight of 3-(4-Formylphenyl)benzoic acid is 226.06 g/mol.
Where can I buy 3-(4-Formylphenyl)benzoic acid?
You can request a quote for 3-(4-Formylphenyl)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-(4-Formylphenyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Formylphenyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.