4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile
TL;DR: 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile (CAS 1023540-16-0) is a chemical compound with molecular formula C12H6Cl2FN3O and molecular weight 296.98718 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(4-amino-3,5-dichloro-6-fluoro-2-pyridinyl)oxy]benzonitrile
Also Known As: 4-(4-AMINO-3,5-DICHLORO-6-FLUORO-2-PYRIDYLOXY)BENZENECARBONITRILE, 4-(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxybenzonitrile, 4-[(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxy]benzonitrile, 4-(4-amino-3,5-dichloro-6-fluoro-pyridin-2-yl)oxybenzonitrile, 4-[(4-amino-3,5-dichloro-6-fluoro-2-pyridyl)oxy]benzonitrile
Technical Specifications
| Molecular Formula | C12H6Cl2FN3O |
| Molecular Weight | 296.98718 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 71.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.98718 Da |
| Heavy Atoms | 19 |
| Complexity | 356.0 |
| SMILES | C1=CC(=CC=C1C#N)OC2=NC(=C(C(=C2Cl)N)Cl)F |
| InChIKey | MUJINSKTXUYLFD-UHFFFAOYSA-N |
Chemical Property Profile of 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile
Property Insights of 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile
The XLogP value of 3.4 indicates that 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile. Following Lipinski's Rule of Five, 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile 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
What is the CAS number of 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile?
The CAS number of 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile is 1023540-16-0.
What is the molecular formula of 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile?
The molecular formula of 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile is C12H6Cl2FN3O.
What is the molecular weight of 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile?
The molecular weight of 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile is 296.98718 g/mol.
Where can I buy 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile?
You can request a quote for 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile?
Yes, CoreyChem provides custom synthesis services for 4-(4-Amino-3,5-dichloro-6-fluoro-2-pyridyloxy)benzenecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.