Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]-
TL;DR: Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]- (CAS 78604-21-4) is a chemical compound with molecular formula C10H12FN3O and molecular weight 209.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[2-(2-fluoroethylimino)hydrazinyl]phenyl]ethanone
Also Known As: 1-[4-[2-(2-fluoroethylimino)hydrazinyl]phenyl]ethanone, Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]-, 1-{4-[(2E)-3-(2-Fluoroethyl)triaz-2-en-1-yl]phenyl}ethan-1-one
| Molecular Formula | C10H12FN3O |
|---|---|
| Molecular Weight | 209.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 53.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 209.09644 |
| Heavy Atoms | 15 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 78604-21-4 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)NN=NCCF |
| InChIKey | RWYPAAMVZPRUQB-UHFFFAOYSA-N |
Product Overview
Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]- (CAS 78604-21-4), with molecular formula C10H12FN3O and molecular weight 209.10 g/mol. IUPAC: 1-[4-[2-(2-fluoroethylimino)hydrazinyl]phenyl]ethanone.
Chemical Property Profile of Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]-
Property Insights of Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]-. With a topological polar surface area (TPSA) of 53.8 Ų, Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]- 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 Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]-?
The CAS number of Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]- is 78604-21-4.
What is the molecular formula of Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]-?
The molecular formula of Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]- is C10H12FN3O.
What is the molecular weight of Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]-?
The molecular weight of Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]- is 209.10 g/mol.
Where can I buy Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]-?
You can request a quote for Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-[4-[3-(2-fluoroethyl)-1-triazenyl]phenyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.