2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine

C12H6ClF4NO — CID 102715210

IUPAC2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine
SMILESFc1cccc(Oc2cc(C(F)(F)F)cc(Cl)n2)c1
InChIInChI=1S/C12H6ClF4NO/c13-10-4-7(12(15,16)17)5-11(18-10)19-9-3-1-2-8(14)6-9/h1-6H
InChIKeyWGFNHHYVYFQRGT-UHFFFAOYSA-N
MW291.63 g/mol
LogP4.69
Rot. Bonds2

About 2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine

2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine (PubChem CID 102715210) has the molecular formula C12H6ClF4NO and a molecular weight of 291.63 g/mol. Its IUPAC name is 2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine
PubChem CID102715210
Molecular FormulaC12H6ClF4NO
Molecular Weight291.63 g/mol
Exact Mass291.01
IUPAC Name2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine
SMILESFc1cccc(Oc2cc(C(F)(F)F)cc(Cl)n2)c1
InChIInChI=1S/C12H6ClF4NO/c13-10-4-7(12(15,16)17)5-11(18-10)19-9-3-1-2-8(14)6-9/h1-6H
InChIKeyWGFNHHYVYFQRGT-UHFFFAOYSA-N
XLogP4.69
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.63
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

4-chloro-6-(3-fluorophenoxy)-2-(trifluoromethyl)pyrimidine
CID 106766711
2-chloro-6-(3-ethoxyphenoxy)-4-(trifluoromethyl)pyridine
CID 102715253
3-[[6-chloro-4-(trifluoromethyl)-2-pyridinyl]oxy]benzonitrile
CID 102715183
2-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine
CID 141360460
2-chloro-6-[3-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile
CID 83072753
2-[4-[[6-chloro-4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]acetonitrile
CID 102715194
2-chloro-4-(3-fluorophenoxy)pyrimidine
CID 53486075
[6-(3-fluorophenoxy)-2-(trifluoromethyl)pyrimidin-4-yl]hydrazine
CID 106776384
2-chloro-6-(2-ethylphenoxy)-4-(trifluoromethyl)pyridine
CID 102715226
6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
CID 102719846
2-chloro-6-(2-nitrophenoxy)-4-(trifluoromethyl)pyridine
CID 102715235
5-chloro-2-(3-fluorophenoxy)pyridine
CID 66233204

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine?
The IUPAC name of 2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine (CID 102715210) is 2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine?
The canonical SMILES for 2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine is Fc1cccc(Oc2cc(C(F)(F)F)cc(Cl)n2)c1.
What is the InChIKey of 2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine?
The InChIKey is WGFNHHYVYFQRGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6ClF4NO/c13-10-4-7(12(15,16)17)5-11(18-10)19-9-3-1-2-8(14)6-9/h1-6H.
What are the key properties of 2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine?
2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine has a molecular weight of 291.63 g/mol, XLogP of 4.69, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine is sourced from PubChem (CID 102715210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).