3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine

C11H5Cl2F3N2O — CID 154125386

IUPAC3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine
SMILESFC(F)(F)c1cc(Oc2ccc(Cl)nn2)ccc1Cl
InChIInChI=1S/C11H5Cl2F3N2O/c12-8-2-1-6(5-7(8)11(14,15)16)19-10-4-3-9(13)17-18-10/h1-5H
InChIKeyPOCQPNJMZDUZFC-UHFFFAOYSA-N
MW309.07 g/mol
LogP4.59
Rot. Bonds2

About 3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine

3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine (PubChem CID 154125386) has the molecular formula C11H5Cl2F3N2O and a molecular weight of 309.07 g/mol. Its IUPAC name is 3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine.

Molecular Properties

Compound Name3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine
PubChem CID154125386
Molecular FormulaC11H5Cl2F3N2O
Molecular Weight309.07 g/mol
Exact Mass307.97
IUPAC Name3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine
SMILESFC(F)(F)c1cc(Oc2ccc(Cl)nn2)ccc1Cl
InChIInChI=1S/C11H5Cl2F3N2O/c12-8-2-1-6(5-7(8)11(14,15)16)19-10-4-3-9(13)17-18-10/h1-5H
InChIKeyPOCQPNJMZDUZFC-UHFFFAOYSA-N
XLogP4.59
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.07
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[4-chloro-3-(trifluoromethyl)phenoxy]pyrimidine
CID 117061351
3-[3-bromo-4-(trifluoromethoxy)phenoxy]-6-chloropyridazine
CID 102714042
4-[4-(bromomethyl)phenoxy]-1-chloro-2-(trifluoromethyl)benzene
CID 67775976
3-chloro-6-phenoxypyridazine;3,6-dichloropyridazine
CID 87882017
1-chloro-4-[(2-methylpropan-2-yl)oxy]-2-(trifluoromethyl)benzene
CID 59627189
3-chloro-6-(3-methoxyphenoxy)pyridazine
CID 13321729
3-(3-bromo-4-methoxyphenoxy)-6-chloropyridazine
CID 87574590
N-[4-(6-chloropyridazin-3-yl)oxyphenyl]-1,1,1-trifluoromethanesulfonamide
CID 13050847
2-[4-[4-chloro-3-(trifluoromethyl)phenoxy]phenyl]ethanamine
CID 86666229
2-[4-[4-chloro-3-(trifluoromethyl)phenoxy]phenyl]ethanol
CID 66825529
2-[4-chloro-3-(trifluoromethyl)phenoxy]ethanamine;hydrochloride
CID 168679987
1,2-dichloro-4-[4-chloro-3-(trifluoromethyl)phenyl]benzene
CID 118805005

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine?
The IUPAC name of 3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine (CID 154125386) is 3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine.
What is the SMILES notation for 3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine?
The canonical SMILES for 3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine is FC(F)(F)c1cc(Oc2ccc(Cl)nn2)ccc1Cl.
What is the InChIKey of 3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine?
The InChIKey is POCQPNJMZDUZFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl2F3N2O/c12-8-2-1-6(5-7(8)11(14,15)16)19-10-4-3-9(13)17-18-10/h1-5H.
What are the key properties of 3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine?
3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine has a molecular weight of 309.07 g/mol, XLogP of 4.59, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-[4-chloro-3-(trifluoromethyl)phenoxy]pyridazine is sourced from PubChem (CID 154125386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).