Ethyl 3-ethoxy-3-iminopropionate hydrochloride
TL;DR: Ethyl 3-ethoxy-3-iminopropionate hydrochloride (CAS 2318-25-4) is a chemical compound with molecular formula C7H14ClNO3 and molecular weight 195.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-ethoxy-3-iminopropanoate;hydrochloride
Also Known As: ethyl 3-ethoxy-3-iminopropanoate hydrochloride, Ethyl 3-ethoxy-3-iminopropionate hydrochloride, Dacarbazine Intermediates, Ethyl carbethoxyacetimidate hydrochloride, Ethyl 3-ethoxy-3-iminopropanoate HCl
| Molecular Formula | C7H14ClNO3 |
|---|---|
| Molecular Weight | 195.07 g/mol |
| LogP | 1.38 |
| Topological Polar Surface Area | 59.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 195.06622 |
| Heavy Atoms | 12 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 2318-25-4 |
|---|---|
| SMILES | CCOC(=N)CC(=O)OCC.Cl |
| InChIKey | HYMXUYQKXCHWDC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 3-ethoxy-3-iminopropionate hydrochloride (CAS 2318-25-4), with molecular formula C7H14ClNO3 and molecular weight 195.07 g/mol. IUPAC: ethyl 3-ethoxy-3-iminopropanoate;hydrochloride.
Chemical Property Profile of Ethyl 3-ethoxy-3-iminopropionate hydrochloride
Property Insights of Ethyl 3-ethoxy-3-iminopropionate hydrochloride
The XLogP value of 1.38 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-ethoxy-3-iminopropionate hydrochloride. With a topological polar surface area (TPSA) of 59.4 Ų, Ethyl 3-ethoxy-3-iminopropionate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-ethoxy-3-iminopropionate hydrochloride has 2 hydrogen bond donor(s) and 4 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-ethoxy-3-iminopropionate hydrochloride?
The CAS number of Ethyl 3-ethoxy-3-iminopropionate hydrochloride is 2318-25-4.
What is the molecular formula of Ethyl 3-ethoxy-3-iminopropionate hydrochloride?
The molecular formula of Ethyl 3-ethoxy-3-iminopropionate hydrochloride is C7H14ClNO3.
What is the molecular weight of Ethyl 3-ethoxy-3-iminopropionate hydrochloride?
The molecular weight of Ethyl 3-ethoxy-3-iminopropionate hydrochloride is 195.07 g/mol.
Where can I buy Ethyl 3-ethoxy-3-iminopropionate hydrochloride?
You can request a quote for Ethyl 3-ethoxy-3-iminopropionate 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-ethoxy-3-iminopropionate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-ethoxy-3-iminopropionate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.