ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride
TL;DR: ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride (CAS 67358-40-1) is a chemical compound with molecular formula C8H11ClN2O2 and molecular weight 202.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride
Also Known As: Ethyl 3-(1H-imidazol-4-yl)acrylate monohydrochloride
| Molecular Formula | C8H11ClN2O2 |
|---|---|
| Molecular Weight | 202.05 g/mol |
| LogP | 1.4078 |
| Topological Polar Surface Area | 54.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.0509 |
| Heavy Atoms | 13 |
| Complexity | 269.6812 |
Chemical Identifiers
| CAS Number | 67358-40-1 |
|---|---|
| SMILES | CCOC(=O)C=CC1=CN=CN1.Cl |
Product Overview
ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride (CAS 67358-40-1), with molecular formula C8H11ClN2O2 and molecular weight 202.05 g/mol. IUPAC: ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride.
Chemical Property Profile of ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride
Property Insights of ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride
The XLogP value of 1.4078 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride. With a topological polar surface area (TPSA) of 54.98 Ų, ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride 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
Frequently Asked Questions
What is the CAS number of ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride?
The CAS number of ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride is 67358-40-1.
What is the molecular formula of ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride?
The molecular formula of ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride is C8H11ClN2O2.
What is the molecular weight of ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride?
The molecular weight of ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride is 202.05 g/mol.
Where can I buy ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride?
You can request a quote for ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-(1H-imidazol-5-yl)prop-2-enoate;hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.