2-Methylimidazole hydrochloride
TL;DR: 2-Methylimidazole hydrochloride (CAS 55514-31-3) is a chemical compound with molecular formula C4H7ClN2 and molecular weight 118.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1H-imidazole;hydrochloride
Also Known As: 2-methylimidazole hydrochloride, 2-methyl-imidazole hydrochloride, 2-methyl-1H-imidazole hydrochloride, Imidazole, 2-methyl-, hydrochloride, 2-methyl-1H-imidazole;hydrochloride
| Molecular Formula | C4H7ClN2 |
|---|---|
| Molecular Weight | 118.03 g/mol |
| LogP | 1.13992 |
| Topological Polar Surface Area | 28.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 118.02978 |
| Heavy Atoms | 7 |
| Complexity | 44.0 |
Chemical Identifiers
| CAS Number | 55514-31-3 |
|---|---|
| SMILES | CC1=NC=CN1.Cl |
| InChIKey | YZPNFYQRPJKWFJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methylimidazole hydrochloride (CAS 55514-31-3), with molecular formula C4H7ClN2 and molecular weight 118.03 g/mol. IUPAC: 2-methyl-1H-imidazole;hydrochloride.
Chemical Property Profile of 2-Methylimidazole hydrochloride
Property Insights of 2-Methylimidazole hydrochloride
The XLogP value of 1.13992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylimidazole hydrochloride. With a topological polar surface area (TPSA) of 28.7 Ų, 2-Methylimidazole hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylimidazole hydrochloride has 2 hydrogen bond donor(s) and 1 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 2-Methylimidazole hydrochloride?
The CAS number of 2-Methylimidazole hydrochloride is 55514-31-3.
What is the molecular formula of 2-Methylimidazole hydrochloride?
The molecular formula of 2-Methylimidazole hydrochloride is C4H7ClN2.
What is the molecular weight of 2-Methylimidazole hydrochloride?
The molecular weight of 2-Methylimidazole hydrochloride is 118.03 g/mol.
Where can I buy 2-Methylimidazole hydrochloride?
You can request a quote for 2-Methylimidazole hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylimidazole hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylimidazole hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.