2-(1-Carboxyethyl)benzoic acid
TL;DR: 2-(1-Carboxyethyl)benzoic acid (CAS 40570-19-2) is a chemical compound with molecular formula C10H10O4 and molecular weight 194.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-carboxyethyl)benzoic acid
Also Known As: Methylhomophthalsaure, 2-(1-carboxyethyl)benzoic acid, 2-(1-carboxyethyl)benzoicacid, ICCB6_000275, 2-(1-Carboxy-ethyl)-benzoic acid
| Molecular Formula | C10H10O4 |
|---|---|
| Molecular Weight | 194.06 g/mol |
| LogP | 1.5729 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.0579 |
| Heavy Atoms | 14 |
| Complexity | 370.13968 |
Chemical Identifiers
| CAS Number | 40570-19-2 |
|---|---|
| SMILES | CC(C1=CC=CC=C1C(=O)O)C(=O)O |
Product Overview
2-(1-Carboxyethyl)benzoic acid (CAS 40570-19-2), with molecular formula C10H10O4 and molecular weight 194.06 g/mol. IUPAC: 2-(1-carboxyethyl)benzoic acid.
Chemical Property Profile of 2-(1-Carboxyethyl)benzoic acid
Property Insights of 2-(1-Carboxyethyl)benzoic acid
The XLogP value of 1.5729 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Carboxyethyl)benzoic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-Carboxyethyl)benzoic acid. Following Lipinski's Rule of Five, 2-(1-Carboxyethyl)benzoic acid has 2 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 2-(1-Carboxyethyl)benzoic acid?
The CAS number of 2-(1-Carboxyethyl)benzoic acid is 40570-19-2.
What is the molecular formula of 2-(1-Carboxyethyl)benzoic acid?
The molecular formula of 2-(1-Carboxyethyl)benzoic acid is C10H10O4.
What is the molecular weight of 2-(1-Carboxyethyl)benzoic acid?
The molecular weight of 2-(1-Carboxyethyl)benzoic acid is 194.06 g/mol.
Where can I buy 2-(1-Carboxyethyl)benzoic acid?
You can request a quote for 2-(1-Carboxyethyl)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-(1-Carboxyethyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Carboxyethyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.