3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine

C10H5ClFN3O3 — CID 60674957

IUPAC3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine
SMILESO=[N+]([O-])c1ccc(F)cc1Oc1ccc(Cl)nn1
InChIInChI=1S/C10H5ClFN3O3/c11-9-3-4-10(14-13-9)18-8-5-6(12)1-2-7(8)15(16)17/h1-5H
InChIKeyYLINRQBUZZYUIQ-UHFFFAOYSA-N
MW269.62 g/mol
LogP2.97
Rot. Bonds3

About 3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine

3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine (PubChem CID 60674957) has the molecular formula C10H5ClFN3O3 and a molecular weight of 269.62 g/mol. Its IUPAC name is 3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine.

Molecular Properties

Compound Name3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine
PubChem CID60674957
Molecular FormulaC10H5ClFN3O3
Molecular Weight269.62 g/mol
Exact Mass269.00
IUPAC Name3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine
SMILESO=[N+]([O-])c1ccc(F)cc1Oc1ccc(Cl)nn1
InChIInChI=1S/C10H5ClFN3O3/c11-9-3-4-10(14-13-9)18-8-5-6(12)1-2-7(8)15(16)17/h1-5H
InChIKeyYLINRQBUZZYUIQ-UHFFFAOYSA-N
XLogP2.97
TPSA78.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.62
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-(2-bromo-3-nitrophenoxy)-6-chloropyridazine
CID 113497819
3-chloro-6-(2-methyl-3-nitrophenoxy)pyridazine
CID 54915539
5-(5-fluoro-2-nitrophenoxy)pyrazin-2-amine
CID 80663467
[6-(5-fluoro-2-nitrophenoxy)pyrimidin-4-yl]hydrazine
CID 80920512
3,5-dichloro-6-(5-fluoro-2-nitrophenoxy)-N-methylpyridin-2-amine
CID 102760813
2-[2-(chloromethyl)-4-fluorophenoxy]-4-fluoro-1-nitrobenzene
CID 61031561
3-chloro-6-(2-methyl-5-nitrophenoxy)pyridazine
CID 54915676
4-fluoro-2-[3-(5-fluoro-2-nitrophenoxy)propoxy]-1-nitrobenzene
CID 7533666
1-[6-(5-fluoro-2-nitrophenoxy)-3-pyridinyl]-N-methylmethanamine
CID 80633902
5-chloro-4-(5-fluoro-2-nitrophenoxy)-1H-pyrimidin-6-one
CID 114676307
5-bromo-2-chloro-4-(5-fluoro-2-nitrophenoxy)pyrimidine
CID 79075513
4-fluoro-2-[(2-methylpropan-2-yl)oxy]-1-nitrobenzene
CID 71757600

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine?
The IUPAC name of 3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine (CID 60674957) is 3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine.
What is the SMILES notation for 3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine?
The canonical SMILES for 3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine is O=[N+]([O-])c1ccc(F)cc1Oc1ccc(Cl)nn1.
What is the InChIKey of 3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine?
The InChIKey is YLINRQBUZZYUIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5ClFN3O3/c11-9-3-4-10(14-13-9)18-8-5-6(12)1-2-7(8)15(16)17/h1-5H.
What are the key properties of 3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine?
3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine has a molecular weight of 269.62 g/mol, XLogP of 2.97, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(5-fluoro-2-nitrophenoxy)pyridazine is sourced from PubChem (CID 60674957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).