1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl-
TL;DR: 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl- (CAS 139742-78-2) is a chemical compound with molecular formula C8H11BrN2O and molecular weight 230.00548 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-2-butyl-1H-imidazole-4-carbaldehyde
Also Known As: 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl-, 5-bromo-2-butyl-1H-imidazole-4-carbaldehyde, 2-Butyl-4-bromo-1H-imidazole-5-carbaldehyde, 4-bromo-2-butyl-1H-imidazole-5-carbaldehyde, 5-Bromo-2-butyl-3H-imidazole-4-carbaldehyde
Technical Specifications
| Molecular Formula | C8H11BrN2O |
| Molecular Weight | 230.00548 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.00548 Da |
| Heavy Atoms | 12 |
| Complexity | 154.0 |
| SMILES | CCCCC1=NC(=C(N1)Br)C=O |
| InChIKey | WMAQGSKZDVUZAV-UHFFFAOYSA-N |
Chemical Property Profile of 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl-
Property Insights of 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl-. With a topological polar surface area (TPSA) of 45.8 Ų, 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl- 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
What is the CAS number of 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl-?
The CAS number of 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl- is 139742-78-2.
What is the molecular formula of 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl-?
The molecular formula of 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl- is C8H11BrN2O.
What is the molecular weight of 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl-?
The molecular weight of 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl- is 230.00548 g/mol.
Where can I buy 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl-?
You can request a quote for 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl-?
Yes, CoreyChem provides custom synthesis services for 1H-Imidazole-4-carboxaldehyde, 5-bromo-2-butyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.