2,5-difluoro-1H-imidazole-4-carboxylic acid
TL;DR: 2,5-difluoro-1H-imidazole-4-carboxylic acid (CAS 89676-60-8) is a chemical compound with molecular formula C4H2F2N2O2 and molecular weight 148.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-difluoro-1H-imidazole-4-carboxylic acid
Also Known As: 2,5-difluoro-1H-imidazole-4-carboxylic acid, 2,4-Difluoroimidazole-5-carboxylic acid, 1H-Imidazole-4-carboxylicacid, 2,5-difluoro-, 2,4-Difluoro-1H-imidazole-5-carboxylic acid, 2,4-difluoro-1 h-imidazole-5-carboxylic acid
| Molecular Formula | C4H2F2N2O2 |
|---|---|
| Molecular Weight | 148.01 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 148.00844 |
| Heavy Atoms | 10 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 89676-60-8 |
|---|---|
| SMILES | C1(=C(NC(=N1)F)F)C(=O)O |
| InChIKey | XLKTZKNVMAATOU-UHFFFAOYSA-N |
Product Overview
2,5-difluoro-1H-imidazole-4-carboxylic acid (CAS 89676-60-8), with molecular formula C4H2F2N2O2 and molecular weight 148.01 g/mol. IUPAC: 2,5-difluoro-1H-imidazole-4-carboxylic acid.
Chemical Property Profile of 2,5-difluoro-1H-imidazole-4-carboxylic acid
Property Insights of 2,5-difluoro-1H-imidazole-4-carboxylic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-difluoro-1H-imidazole-4-carboxylic acid. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-difluoro-1H-imidazole-4-carboxylic acid. Following Lipinski's Rule of Five, 2,5-difluoro-1H-imidazole-4-carboxylic acid has 2 hydrogen bond donor(s) and 5 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-difluoro-1H-imidazole-4-carboxylic acid?
The CAS number of 2,5-difluoro-1H-imidazole-4-carboxylic acid is 89676-60-8.
What is the molecular formula of 2,5-difluoro-1H-imidazole-4-carboxylic acid?
The molecular formula of 2,5-difluoro-1H-imidazole-4-carboxylic acid is C4H2F2N2O2.
What is the molecular weight of 2,5-difluoro-1H-imidazole-4-carboxylic acid?
The molecular weight of 2,5-difluoro-1H-imidazole-4-carboxylic acid is 148.01 g/mol.
Where can I buy 2,5-difluoro-1H-imidazole-4-carboxylic acid?
You can request a quote for 2,5-difluoro-1H-imidazole-4-carboxylic 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-difluoro-1H-imidazole-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,5-difluoro-1H-imidazole-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.