4-(1-Amino-2-carboxy-ethyl)-benzoic acid
TL;DR: 4-(1-Amino-2-carboxy-ethyl)-benzoic acid (CAS 682804-01-9) is a chemical compound with molecular formula C10H11NO4 and molecular weight 209.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-amino-2-carboxyethyl)benzoic acid
Also Known As: celiprolol, 4- -benzoicacid, 4-(1-amino-2-carboxyethyl)benzoic acid, 4-(1-AMINO-2-CARBOXY-ETHYL)-BENZOIC ACID, 4-(1-amino-2-carboxy-ethyl)benzoic acid
| Molecular Formula | C10H11NO4 |
|---|---|
| Molecular Weight | 209.07 g/mol |
| LogP | 0.8593 |
| Topological Polar Surface Area | 100.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 209.0688 |
| Heavy Atoms | 15 |
| Complexity | 371.5137 |
Chemical Identifiers
| CAS Number | 682804-01-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C(CC(=O)O)N)C(=O)O |
Product Overview
4-(1-Amino-2-carboxy-ethyl)-benzoic acid (CAS 682804-01-9), with molecular formula C10H11NO4 and molecular weight 209.07 g/mol. IUPAC: 4-(1-amino-2-carboxyethyl)benzoic acid.
Chemical Property Profile of 4-(1-Amino-2-carboxy-ethyl)-benzoic acid
Property Insights of 4-(1-Amino-2-carboxy-ethyl)-benzoic acid
The XLogP value of 0.8593 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1-Amino-2-carboxy-ethyl)-benzoic acid. The TPSA of 100.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(1-Amino-2-carboxy-ethyl)-benzoic acid. Following Lipinski's Rule of Five, 4-(1-Amino-2-carboxy-ethyl)-benzoic acid has 3 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 4-(1-Amino-2-carboxy-ethyl)-benzoic acid?
The CAS number of 4-(1-Amino-2-carboxy-ethyl)-benzoic acid is 682804-01-9.
What is the molecular formula of 4-(1-Amino-2-carboxy-ethyl)-benzoic acid?
The molecular formula of 4-(1-Amino-2-carboxy-ethyl)-benzoic acid is C10H11NO4.
What is the molecular weight of 4-(1-Amino-2-carboxy-ethyl)-benzoic acid?
The molecular weight of 4-(1-Amino-2-carboxy-ethyl)-benzoic acid is 209.07 g/mol.
Where can I buy 4-(1-Amino-2-carboxy-ethyl)-benzoic acid?
You can request a quote for 4-(1-Amino-2-carboxy-ethyl)-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-(1-Amino-2-carboxy-ethyl)-benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(1-Amino-2-carboxy-ethyl)-benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.