2,5-Diaminoterephthalic acid
TL;DR: 2,5-Diaminoterephthalic acid (CAS 945-30-2) is a chemical compound with molecular formula C8H8N2O4 and molecular weight 196.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-diaminoterephthalic acid
Also Known As: 2,5-diaminoterephthalic acid, DATPA, 2,5-diaminobenzene-1,4-dicarboxylic acid, 2,5-DIAMINOTEREPHTHALICACID, 2,5-diazaniumylterephthalate
| Molecular Formula | C8H8N2O4 |
|---|---|
| Molecular Weight | 196.05 g/mol |
| LogP | 0.2474 |
| Topological Polar Surface Area | 126.64 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.0484 |
| Heavy Atoms | 14 |
| Complexity | 374.29745 |
Chemical Identifiers
| CAS Number | 945-30-2 |
|---|---|
| SMILES | C1=C(C(=CC(=C1N)C(=O)O)N)C(=O)O |
Product Overview
2,5-Diaminoterephthalic acid (CAS 945-30-2), with molecular formula C8H8N2O4 and molecular weight 196.05 g/mol. IUPAC: 2,5-diaminoterephthalic acid.
Chemical Property Profile of 2,5-Diaminoterephthalic acid
Property Insights of 2,5-Diaminoterephthalic acid
The XLogP value of 0.2474 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Diaminoterephthalic acid. The TPSA of 126.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Diaminoterephthalic acid. Following Lipinski's Rule of Five, 2,5-Diaminoterephthalic acid has 4 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 2,5-Diaminoterephthalic acid?
The CAS number of 2,5-Diaminoterephthalic acid is 945-30-2.
What is the molecular formula of 2,5-Diaminoterephthalic acid?
The molecular formula of 2,5-Diaminoterephthalic acid is C8H8N2O4.
What is the molecular weight of 2,5-Diaminoterephthalic acid?
The molecular weight of 2,5-Diaminoterephthalic acid is 196.05 g/mol.
Where can I buy 2,5-Diaminoterephthalic acid?
You can request a quote for 2,5-Diaminoterephthalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Diaminoterephthalic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Diaminoterephthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.