Imidazole-1-butyric acid, 2-methyl-
TL;DR: Imidazole-1-butyric acid, 2-methyl- (CAS 110525-54-7) is a chemical compound with molecular formula C8H12N2O2 and molecular weight 168.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-methylimidazol-1-yl)butanoic acid
Also Known As: 4-(2-methyl-1H-imidazol-1-yl)butanoic acid, 4-(2-methylimidazol-1-yl)butanoic acid, 2-Methylimidazole-1-butyric acid, Imidazole-1-butyric acid, 2-methyl-, 1H-Imidazole-1-butanoicacid, 2-methyl-
Technical Specifications
| Molecular Formula | C8H12N2O2 |
| Molecular Weight | 168.08987 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.08987 Da |
| Heavy Atoms | 12 |
| Complexity | 161.0 |
| SMILES | CC1=NC=CN1CCCC(=O)O |
| InChIKey | ILAKRGWTYGOVOH-UHFFFAOYSA-N |
Chemical Property Profile of Imidazole-1-butyric acid, 2-methyl-
Property Insights of Imidazole-1-butyric acid, 2-methyl-
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imidazole-1-butyric acid, 2-methyl-. With a topological polar surface area (TPSA) of 55.1 Ų, Imidazole-1-butyric acid, 2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Imidazole-1-butyric acid, 2-methyl- 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 Imidazole-1-butyric acid, 2-methyl-?
The CAS number of Imidazole-1-butyric acid, 2-methyl- is 110525-54-7.
What is the molecular formula of Imidazole-1-butyric acid, 2-methyl-?
The molecular formula of Imidazole-1-butyric acid, 2-methyl- is C8H12N2O2.
What is the molecular weight of Imidazole-1-butyric acid, 2-methyl-?
The molecular weight of Imidazole-1-butyric acid, 2-methyl- is 168.08987 g/mol.
Where can I buy Imidazole-1-butyric acid, 2-methyl-?
You can request a quote for Imidazole-1-butyric acid, 2-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Imidazole-1-butyric acid, 2-methyl-?
Yes, CoreyChem provides custom synthesis services for Imidazole-1-butyric acid, 2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.