5-Azidoisophthalic acid
TL;DR: 5-Azidoisophthalic acid (CAS 3600-77-9) is a chemical compound with molecular formula C8H5N3O4 and molecular weight 207.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-azidobenzene-1,3-dicarboxylic acid
Also Known As: 5-Azidoisophthalic acid, 5-Azidoisophthalate, 5-azidobenzene-1,3-dicarboxylic acid, 1,3-Benzenedicarboxylic acid, 5-azido-, J3.647.366E
| Molecular Formula | C8H5N3O4 |
|---|---|
| Molecular Weight | 207.03 g/mol |
| LogP | 2.0248 |
| Topological Polar Surface Area | 123.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.028 |
| Heavy Atoms | 15 |
| Complexity | 414.29733 |
Chemical Identifiers
| CAS Number | 3600-77-9 |
|---|---|
| SMILES | C1=C(C=C(C=C1C(=O)O)N=[N+]=[N-])C(=O)O |
Product Overview
5-Azidoisophthalic acid (CAS 3600-77-9), with molecular formula C8H5N3O4 and molecular weight 207.03 g/mol. IUPAC: 5-azidobenzene-1,3-dicarboxylic acid.
Chemical Property Profile of 5-Azidoisophthalic acid
Property Insights of 5-Azidoisophthalic acid
The XLogP value of 2.0248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Azidoisophthalic acid. The TPSA of 123.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Azidoisophthalic acid. Following Lipinski's Rule of Five, 5-Azidoisophthalic acid has 2 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 5-Azidoisophthalic acid?
The CAS number of 5-Azidoisophthalic acid is 3600-77-9.
What is the molecular formula of 5-Azidoisophthalic acid?
The molecular formula of 5-Azidoisophthalic acid is C8H5N3O4.
What is the molecular weight of 5-Azidoisophthalic acid?
The molecular weight of 5-Azidoisophthalic acid is 207.03 g/mol.
Where can I buy 5-Azidoisophthalic acid?
You can request a quote for 5-Azidoisophthalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Azidoisophthalic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Azidoisophthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.