1H-imidazole-1-carboxylic acid
TL;DR: 1H-imidazole-1-carboxylic acid (CAS 58978-32-8) is a chemical compound with molecular formula C4H4N2O2 and molecular weight 112.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
imidazole-1-carboxylic acid
Also Known As: 1H-imidazole-1-carboxylic acid, imidazole-1-carboxylic acid, Ozagrel Impurity 81, imidazolium carboxylate, Imidazol-1-carbonsaeure
| Molecular Formula | C4H4N2O2 |
|---|---|
| Molecular Weight | 112.03 g/mol |
| LogP | 0.4092 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 112.027275 |
| Heavy Atoms | 8 |
| Complexity | 179.92819 |
Chemical Identifiers
| CAS Number | 58978-32-8 |
|---|---|
| SMILES | C1=CN(C=N1)C(=O)O |
Product Overview
1H-imidazole-1-carboxylic acid (CAS 58978-32-8), with molecular formula C4H4N2O2 and molecular weight 112.03 g/mol. IUPAC: imidazole-1-carboxylic acid.
Chemical Property Profile of 1H-imidazole-1-carboxylic acid
Property Insights of 1H-imidazole-1-carboxylic acid
The XLogP value of 0.4092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-imidazole-1-carboxylic acid. With a topological polar surface area (TPSA) of 55.12 Ų, 1H-imidazole-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-imidazole-1-carboxylic acid has 1 hydrogen bond donor(s) and 2 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 1H-imidazole-1-carboxylic acid?
The CAS number of 1H-imidazole-1-carboxylic acid is 58978-32-8.
What is the molecular formula of 1H-imidazole-1-carboxylic acid?
The molecular formula of 1H-imidazole-1-carboxylic acid is C4H4N2O2.
What is the molecular weight of 1H-imidazole-1-carboxylic acid?
The molecular weight of 1H-imidazole-1-carboxylic acid is 112.03 g/mol.
Where can I buy 1H-imidazole-1-carboxylic acid?
You can request a quote for 1H-imidazole-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-imidazole-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1H-imidazole-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.