1-Methylimidazole-5-acetic acid
TL;DR: 1-Methylimidazole-5-acetic acid (CAS 1071661-55-6) is a chemical compound with molecular formula C6H8N2O2 and molecular weight 140.05858 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-methylimidazol-4-yl)acetic acid
Also Known As: P-Miaa, 2-(1-methyl-1H-imidazol-5-yl)acetic acid, Pi-Methylimidazoleacetic acid, 1-Methyl-5-imidazoleacetic acid, 2-(3-methylimidazol-4-yl)acetic acid
Technical Specifications
| Molecular Formula | C6H8N2O2 |
| Molecular Weight | 140.05858 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 140.05858 Da |
| Heavy Atoms | 10 |
| Complexity | 138.0 |
| SMILES | CN1C=NC=C1CC(=O)O |
| InChIKey | UJCGYTCAMOHYCG-UHFFFAOYSA-N |
Chemical Property Profile of 1-Methylimidazole-5-acetic acid
Property Insights of 1-Methylimidazole-5-acetic acid
The XLogP value of -0.5 indicates that 1-Methylimidazole-5-acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.1 Ų, 1-Methylimidazole-5-acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylimidazole-5-acetic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Methylimidazole-5-acetic acid?
The CAS number of 1-Methylimidazole-5-acetic acid is 1071661-55-6.
What is the molecular formula of 1-Methylimidazole-5-acetic acid?
The molecular formula of 1-Methylimidazole-5-acetic acid is C6H8N2O2.
What is the molecular weight of 1-Methylimidazole-5-acetic acid?
The molecular weight of 1-Methylimidazole-5-acetic acid is 140.05858 g/mol.
Where can I buy 1-Methylimidazole-5-acetic acid?
You can request a quote for 1-Methylimidazole-5-acetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Methylimidazole-5-acetic acid?
Yes, CoreyChem provides custom synthesis services for 1-Methylimidazole-5-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.