Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride
TL;DR: Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride (CAS 454470-11-2) is a chemical compound with molecular formula C9H10Cl2FNO and molecular weight 237.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride
Also Known As: ethyl 3-chloro-4-fluorobenzenecarboximidate hydrochloride, Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride, (3-chloro-4-fluoro-phenyl)-ethoxy-methanimine Hydrochloride
| Molecular Formula | C9H10Cl2FNO |
|---|---|
| Molecular Weight | 237.01 g/mol |
| LogP | 3.26277 |
| Topological Polar Surface Area | 33.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.01234 |
| Heavy Atoms | 14 |
| Complexity | 330.58804 |
Chemical Identifiers
| CAS Number | 454470-11-2 |
|---|---|
| SMILES | CCOC(=N)C1=CC(=C(C=C1)F)Cl.Cl |
Product Overview
Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride (CAS 454470-11-2), with molecular formula C9H10Cl2FNO and molecular weight 237.01 g/mol. IUPAC: ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride.
Chemical Property Profile of Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride
Property Insights of Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride
The XLogP value of 3.26277 indicates that Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.08 Ų, Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride 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
Frequently Asked Questions
What is the CAS number of Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride?
The CAS number of Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride is 454470-11-2.
What is the molecular formula of Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride?
The molecular formula of Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride is C9H10Cl2FNO.
What is the molecular weight of Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride?
The molecular weight of Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride is 237.01 g/mol.
Where can I buy Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride?
You can request a quote for Ethyl 3-chloro-4-fluorobenzenecarboximidate;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-chloro-4-fluorobenzenecarboximidate;hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-chloro-4-fluorobenzenecarboximidate;hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.