2-(3,4-diaminophenyl)acetic Acid
TL;DR: 2-(3,4-diaminophenyl)acetic Acid (CAS 621-43-2) is a chemical compound with molecular formula C8H10N2O2 and molecular weight 166.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-diaminophenyl)acetic acid
Also Known As: 2-(3,4-diaminophenyl)acetic Acid, Metacetamol, Benzeneacetic acid, 3,4-diamino-, 3,4-diaminoBenzeneacetic acid, 3,4-diaminophenylacetic acid
| Molecular Formula | C8H10N2O2 |
|---|---|
| Molecular Weight | 166.07 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 89.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.07423 |
| Heavy Atoms | 12 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 621-43-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1CC(=O)O)N)N |
| InChIKey | LIOBPVZSSVYQSS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(3,4-diaminophenyl)acetic Acid (CAS 621-43-2), with molecular formula C8H10N2O2 and molecular weight 166.07 g/mol. IUPAC: 2-(3,4-diaminophenyl)acetic acid.
Chemical Property Profile of 2-(3,4-diaminophenyl)acetic Acid
Property Insights of 2-(3,4-diaminophenyl)acetic Acid
The XLogP value of -0.3 indicates that 2-(3,4-diaminophenyl)acetic Acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-diaminophenyl)acetic Acid. Following Lipinski's Rule of Five, 2-(3,4-diaminophenyl)acetic Acid has 3 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 2-(3,4-diaminophenyl)acetic Acid?
The CAS number of 2-(3,4-diaminophenyl)acetic Acid is 621-43-2.
What is the molecular formula of 2-(3,4-diaminophenyl)acetic Acid?
The molecular formula of 2-(3,4-diaminophenyl)acetic Acid is C8H10N2O2.
What is the molecular weight of 2-(3,4-diaminophenyl)acetic Acid?
The molecular weight of 2-(3,4-diaminophenyl)acetic Acid is 166.07 g/mol.
Where can I buy 2-(3,4-diaminophenyl)acetic Acid?
You can request a quote for 2-(3,4-diaminophenyl)acetic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-diaminophenyl)acetic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-diaminophenyl)acetic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.