3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine

C10H5Cl2FN2O — CID 45035519

IUPAC3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine
SMILESFc1ccc(Oc2ccc(Cl)nn2)cc1Cl
InChIInChI=1S/C10H5Cl2FN2O/c11-7-5-6(1-2-8(7)13)16-10-4-3-9(12)14-15-10/h1-5H
InChIKeyWBLIRPSCEJIYFL-UHFFFAOYSA-N
MW259.07 g/mol
LogP3.71
Rot. Bonds2

About 3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine

3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine (PubChem CID 45035519) has the molecular formula C10H5Cl2FN2O and a molecular weight of 259.07 g/mol. Its IUPAC name is 3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine.

Molecular Properties

Compound Name3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine
PubChem CID45035519
Molecular FormulaC10H5Cl2FN2O
Molecular Weight259.07 g/mol
Exact Mass257.98
IUPAC Name3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine
SMILESFc1ccc(Oc2ccc(Cl)nn2)cc1Cl
InChIInChI=1S/C10H5Cl2FN2O/c11-7-5-6(1-2-8(7)13)16-10-4-3-9(12)14-15-10/h1-5H
InChIKeyWBLIRPSCEJIYFL-UHFFFAOYSA-N
XLogP3.71
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.07
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine?
The IUPAC name of 3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine (CID 45035519) is 3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine.
What is the SMILES notation for 3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine?
The canonical SMILES for 3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine is Fc1ccc(Oc2ccc(Cl)nn2)cc1Cl.
What is the InChIKey of 3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine?
The InChIKey is WBLIRPSCEJIYFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Cl2FN2O/c11-7-5-6(1-2-8(7)13)16-10-4-3-9(12)14-15-10/h1-5H.
What are the key properties of 3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine?
3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine has a molecular weight of 259.07 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(3-chloro-4-fluorophenoxy)pyridazine is sourced from PubChem (CID 45035519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).