2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine

C12H5Cl2F4N — CID 118836217

IUPAC2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine
SMILESFc1ccc(C(F)(F)F)nc1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C12H5Cl2F4N/c13-6-1-2-7(8(14)5-6)11-9(15)3-4-10(19-11)12(16,17)18/h1-5H
InChIKeyVXGYUNULCKFMNR-UHFFFAOYSA-N
MW310.08 g/mol
LogP5.21
Rot. Bonds1

About 2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine

2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine (PubChem CID 118836217) has the molecular formula C12H5Cl2F4N and a molecular weight of 310.08 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine
PubChem CID118836217
Molecular FormulaC12H5Cl2F4N
Molecular Weight310.08 g/mol
Exact Mass308.97
IUPAC Name2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine
SMILESFc1ccc(C(F)(F)F)nc1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C12H5Cl2F4N/c13-6-1-2-7(8(14)5-6)11-9(15)3-4-10(19-11)12(16,17)18/h1-5H
InChIKeyVXGYUNULCKFMNR-UHFFFAOYSA-N
XLogP5.21
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.08
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,4-dichlorophenyl)-3-methoxy-6-(trifluoromethyl)pyridine
CID 118841877
3-fluoro-2-(3,4,5-trichlorophenyl)-6-(trifluoromethyl)pyridine
CID 134636331
2-(2,4-dichlorophenyl)-3-fluoro-6-methylpyridine
CID 170837737
2-chloro-4-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyrimidine
CID 57468690
2-(2,4,6-trichlorophenyl)-3,6-bis(trifluoromethyl)pyridine
CID 134635776
2-(2,3,5-trichlorophenyl)-3,6-bis(trifluoromethyl)pyridine
CID 134637270
7-chloro-2-(trifluoromethyl)quinoline
CID 11031724
3-chloro-2-(2,3,4-trichlorophenyl)-6-(trifluoromethyl)pyridine
CID 134636029
4-(2,4-dichlorophenyl)-2-phenyl-6-(trifluoromethyl)pyrimidine
CID 91926431
6-chloro-2,3-bis(2,4-dichlorophenyl)pyridine
CID 133088206
2-(2,4-dichlorophenyl)-4-fluoro-5-(trifluoromethyl)pyridine
CID 118847434
2,4-dichloro-1-[4-(trifluoromethyl)phenyl]benzene
CID 54501466

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine?
The IUPAC name of 2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine (CID 118836217) is 2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine?
The canonical SMILES for 2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine is Fc1ccc(C(F)(F)F)nc1-c1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine?
The InChIKey is VXGYUNULCKFMNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H5Cl2F4N/c13-6-1-2-7(8(14)5-6)11-9(15)3-4-10(19-11)12(16,17)18/h1-5H.
What are the key properties of 2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine?
2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine has a molecular weight of 310.08 g/mol, XLogP of 5.21, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-3-fluoro-6-(trifluoromethyl)pyridine is sourced from PubChem (CID 118836217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).