3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine

C11H8ClFN2O — CID 134102120

IUPAC3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine
SMILESFc1cccc(Cl)c1COc1cccnn1
InChIInChI=1S/C11H8ClFN2O/c12-9-3-1-4-10(13)8(9)7-16-11-5-2-6-14-15-11/h1-6H,7H2
InChIKeyAYAYJJSVVXEZKF-UHFFFAOYSA-N
MW238.65 g/mol
LogP2.85
Rot. Bonds3

About 3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine

3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine (PubChem CID 134102120) has the molecular formula C11H8ClFN2O and a molecular weight of 238.65 g/mol. Its IUPAC name is 3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine.

Molecular Properties

Compound Name3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine
PubChem CID134102120
Molecular FormulaC11H8ClFN2O
Molecular Weight238.65 g/mol
Exact Mass238.03
IUPAC Name3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine
SMILESFc1cccc(Cl)c1COc1cccnn1
InChIInChI=1S/C11H8ClFN2O/c12-9-3-1-4-10(13)8(9)7-16-11-5-2-6-14-15-11/h1-6H,7H2
InChIKeyAYAYJJSVVXEZKF-UHFFFAOYSA-N
XLogP2.85
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.65
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine?
The IUPAC name of 3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine (CID 134102120) is 3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine.
What is the SMILES notation for 3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine?
The canonical SMILES for 3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine is Fc1cccc(Cl)c1COc1cccnn1.
What is the InChIKey of 3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine?
The InChIKey is AYAYJJSVVXEZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClFN2O/c12-9-3-1-4-10(13)8(9)7-16-11-5-2-6-14-15-11/h1-6H,7H2.
What are the key properties of 3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine?
3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine has a molecular weight of 238.65 g/mol, XLogP of 2.85, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-chloro-6-fluorophenyl)methoxy]pyridazine is sourced from PubChem (CID 134102120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).