4-(2-Aminoethylamino)benzoic acid
TL;DR: 4-(2-Aminoethylamino)benzoic acid (CAS 227312-86-9) is a chemical compound with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-aminoethylamino)benzoic acid
Also Known As: 4-(2-aminoethylamino)benzoic Acid, 4-(2-amino-ethylamino)benzoic acid
| Molecular Formula | C9H12N2O2 |
|---|---|
| Molecular Weight | 180.09 g/mol |
| LogP | 0.7554 |
| Topological Polar Surface Area | 75.35 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.08987 |
| Heavy Atoms | 13 |
| Complexity | 282.1711 |
Chemical Identifiers
| CAS Number | 227312-86-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)NCCN |
Product Overview
4-(2-Aminoethylamino)benzoic acid (CAS 227312-86-9), with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol. IUPAC: 4-(2-aminoethylamino)benzoic acid.
Chemical Property Profile of 4-(2-Aminoethylamino)benzoic acid
Property Insights of 4-(2-Aminoethylamino)benzoic acid
The XLogP value of 0.7554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Aminoethylamino)benzoic acid. The TPSA of 75.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Aminoethylamino)benzoic acid. Following Lipinski's Rule of Five, 4-(2-Aminoethylamino)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-(2-Aminoethylamino)benzoic acid?
The CAS number of 4-(2-Aminoethylamino)benzoic acid is 227312-86-9.
What is the molecular formula of 4-(2-Aminoethylamino)benzoic acid?
The molecular formula of 4-(2-Aminoethylamino)benzoic acid is C9H12N2O2.
What is the molecular weight of 4-(2-Aminoethylamino)benzoic acid?
The molecular weight of 4-(2-Aminoethylamino)benzoic acid is 180.09 g/mol.
Where can I buy 4-(2-Aminoethylamino)benzoic acid?
You can request a quote for 4-(2-Aminoethylamino)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-Aminoethylamino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Aminoethylamino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.