1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)-
TL;DR: 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)- (CAS 54060-80-9) is a chemical compound with molecular formula C7H8N2O and molecular weight 136.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-imidazol-1-yl-2-methylprop-2-en-1-one
Also Known As: N-Methacryloylimidazole, 1-Methacryloyl imidazole, N-(2-Methylacryloyl)imidazola, 1-Methacryloyl-1H-imidazole, 1-Methacryloyl-1H-imidazole #
| Molecular Formula | C7H8N2O |
|---|---|
| Molecular Weight | 136.06 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 34.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 136.06366 |
| Heavy Atoms | 10 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 54060-80-9 |
|---|---|
| SMILES | CC(=C)C(=O)N1C=CN=C1 |
| InChIKey | OMRBLVYISVXTDL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)- (CAS 54060-80-9), with molecular formula C7H8N2O and molecular weight 136.06 g/mol. IUPAC: 1-imidazol-1-yl-2-methylprop-2-en-1-one.
Chemical Property Profile of 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)-
Property Insights of 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)-. With a topological polar surface area (TPSA) of 34.9 Ų, 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)- has 0 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-(2-methyl-1-oxo-2-propenyl)-?
The CAS number of 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)- is 54060-80-9.
What is the molecular formula of 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)-?
The molecular formula of 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)- is C7H8N2O.
What is the molecular weight of 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)-?
The molecular weight of 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)- is 136.06 g/mol.
Where can I buy 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)-?
You can request a quote for 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)- 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-(2-methyl-1-oxo-2-propenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole, 1-(2-methyl-1-oxo-2-propenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.