Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate
TL;DR: Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate (CAS 478048-48-5) is a chemical compound with molecular formula C11H9F2N3O2 and molecular weight 253.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-cyano-2-[(2,6-difluorophenyl)hydrazinylidene]acetate
Also Known As: ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate, ethyl 2-cyano-2-[2-(2,6-difluorophenyl)hydrazono]acetate, ethyl 2-cyano-2-[(2,6-difluorophenyl)hydrazinylidene]acetate
| Molecular Formula | C11H9F2N3O2 |
|---|---|
| Molecular Weight | 253.07 g/mol |
| LogP | 1.81938 |
| Topological Polar Surface Area | 74.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.06628 |
| Heavy Atoms | 18 |
| Complexity | 503.2599 |
Chemical Identifiers
| CAS Number | 478048-48-5 |
|---|---|
| SMILES | CCOC(=O)C(=NNC1=C(C=CC=C1F)F)C#N |
Product Overview
Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate (CAS 478048-48-5), with molecular formula C11H9F2N3O2 and molecular weight 253.07 g/mol. IUPAC: ethyl 2-cyano-2-[(2,6-difluorophenyl)hydrazinylidene]acetate.
Chemical Property Profile of Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate
Property Insights of Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate
The XLogP value of 1.81938 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate. The TPSA of 74.48 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate. Following Lipinski's Rule of Five, Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]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 cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate?
The CAS number of Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate is 478048-48-5.
What is the molecular formula of Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate?
The molecular formula of Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate is C11H9F2N3O2.
What is the molecular weight of Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate?
The molecular weight of Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate is 253.07 g/mol.
Where can I buy Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate?
You can request a quote for Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl cyano[2-(2,6-difluorophenyl)hydrazin-1-ylidene]formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.