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Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate
TL;DR: Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate (CAS 3994-24-9) is a chemical compound with molecular formula C11H10ClN3O2 and molecular weight 251.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(4-chlorophenyl)hydrazinylidene]-2-cyanoacetate
Also Known As: ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate, ethyl 2-[2-(4-chlorophenyl)hydrazono]-2-cyanoacetate, Cyanoglyoxylic acid ethyl ester 2-(p-chlorophenyl)hydrazone, ethyl 2-[(4-chlorophenyl)hydrazono]-2-cyano-acetate, Ethyl [2-(4-chlorophenyl)hydrazinylidene](cyano)acetate
| Molecular Formula | C11H10ClN3O2 |
|---|---|
| Molecular Weight | 251.05 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 74.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 251.04616 |
| Heavy Atoms | 17 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 3994-24-9 |
|---|---|
| SMILES | CCOC(=O)C(=NNC1=CC=C(C=C1)Cl)C#N |
| InChIKey | PQDRRQIRVTVLBS-UHFFFAOYSA-N |
Product Overview
Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate (CAS 3994-24-9), with molecular formula C11H10ClN3O2 and molecular weight 251.05 g/mol. IUPAC: ethyl 2-[(4-chlorophenyl)hydrazinylidene]-2-cyanoacetate.
Chemical Property Profile of Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate
Property Insights of Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate
The XLogP value of 3.9 indicates that Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate. Following Lipinski's Rule of Five, Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate has 1 hydrogen bond donor(s) and 5 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 [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate?
The CAS number of Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate is 3994-24-9.
What is the molecular formula of Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate?
The molecular formula of Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate is C11H10ClN3O2.
What is the molecular weight of Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate?
The molecular weight of Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate is 251.05 g/mol.
Where can I buy Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate?
You can request a quote for Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl [2-(4-chlorophenyl)hydrazin-1-ylidene](cyano)formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.