4-(2-Carboxyethenyl)benzoic acid
TL;DR: 4-(2-Carboxyethenyl)benzoic acid (CAS 19675-63-9) is a chemical compound with molecular formula C10H8O4 and molecular weight 192.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-carboxyethenyl)benzoic acid
Also Known As: 4-(2-Carboxyvinyl)benzoic acid, 4-CARBOXYCINNAMIC ACID, 4-(2-carboxyethenyl)benzoic acid, (e)-4-(2-carboxyvinyl)benzoic acid, 4-(2-Carboxyvinyl)benzoicacid
| Molecular Formula | C10H8O4 |
|---|---|
| Molecular Weight | 192.04 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.04225 |
| Heavy Atoms | 14 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 19675-63-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C=CC(=O)O)C(=O)O |
| InChIKey | HAEJSGLKJYIYTB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(2-Carboxyethenyl)benzoic acid (CAS 19675-63-9), with molecular formula C10H8O4 and molecular weight 192.04 g/mol. IUPAC: 4-(2-carboxyethenyl)benzoic acid.
Chemical Property Profile of 4-(2-Carboxyethenyl)benzoic acid
Property Insights of 4-(2-Carboxyethenyl)benzoic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Carboxyethenyl)benzoic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Carboxyethenyl)benzoic acid. Following Lipinski's Rule of Five, 4-(2-Carboxyethenyl)benzoic acid has 2 hydrogen bond donor(s) and 4 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 4-(2-Carboxyethenyl)benzoic acid?
The CAS number of 4-(2-Carboxyethenyl)benzoic acid is 19675-63-9.
What is the molecular formula of 4-(2-Carboxyethenyl)benzoic acid?
The molecular formula of 4-(2-Carboxyethenyl)benzoic acid is C10H8O4.
What is the molecular weight of 4-(2-Carboxyethenyl)benzoic acid?
The molecular weight of 4-(2-Carboxyethenyl)benzoic acid is 192.04 g/mol.
Where can I buy 4-(2-Carboxyethenyl)benzoic acid?
You can request a quote for 4-(2-Carboxyethenyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Carboxyethenyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Carboxyethenyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.