3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine

C12H4Cl4F3N — CID 134636127

IUPAC3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccnc(-c2c(Cl)cc(Cl)cc2Cl)c1Cl
InChIInChI=1S/C12H4Cl4F3N/c13-5-3-7(14)9(8(15)4-5)11-10(16)6(1-2-20-11)12(17,18)19/h1-4H
InChIKeySUIHMGSLTMKHBD-UHFFFAOYSA-N
MW360.98 g/mol
LogP6.38
Rot. Bonds1

About 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine

3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine (PubChem CID 134636127) has the molecular formula C12H4Cl4F3N and a molecular weight of 360.98 g/mol. Its IUPAC name is 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine
PubChem CID134636127
Molecular FormulaC12H4Cl4F3N
Molecular Weight360.98 g/mol
Exact Mass358.90
IUPAC Name3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccnc(-c2c(Cl)cc(Cl)cc2Cl)c1Cl
InChIInChI=1S/C12H4Cl4F3N/c13-5-3-7(14)9(8(15)4-5)11-10(16)6(1-2-20-11)12(17,18)19/h1-4H
InChIKeySUIHMGSLTMKHBD-UHFFFAOYSA-N
XLogP6.38
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.98
LogP ≤ 56.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-iodo-2-(2,4,6-trichlorophenyl)-3-(trifluoromethyl)pyridine
CID 134636380
2,3-dichloro-4-(trifluoromethyl)pyridine
CID 15132714
2-(2,4,6-trichlorophenyl)-3,6-bis(trifluoromethyl)pyridine
CID 134635776
2,6-bis(2,4,6-trichlorophenyl)-3-(trifluoromethyl)pyridine
CID 134635943
2-(2,4-dichlorophenyl)-4-(trifluoromethyl)pyridine-3-carbaldehyde
CID 118802444
2-(2,6-dichlorophenyl)-3-methoxy-4-(trifluoromethyl)pyridine
CID 118830574
2-(2,4-dichlorophenyl)-4-(trifluoromethyl)pyridine-3-carboxylic acid
CID 118802456
2-fluoro-4-(2,3,5-trichlorophenyl)-3-(trifluoromethyl)pyridine
CID 134637677
3-iodo-2-(2,3,4-trichlorophenyl)-4-(trifluoromethyl)pyridine
CID 134637890
2-[3-chloro-4-(trifluoromethyl)-2-pyridinyl]acetic acid
CID 131611741
4-(2,4,6-trichlorophenyl)-2-(trifluoromethyl)pyridin-3-ol
CID 133092449
2-iodo-3-(2,3,4,5,6-pentachlorophenyl)-4-(trifluoromethyl)pyridine
CID 134620489

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine?
The IUPAC name of 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine (CID 134636127) is 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine.
What is the SMILES notation for 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine?
The canonical SMILES for 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine is FC(F)(F)c1ccnc(-c2c(Cl)cc(Cl)cc2Cl)c1Cl.
What is the InChIKey of 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine?
The InChIKey is SUIHMGSLTMKHBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H4Cl4F3N/c13-5-3-7(14)9(8(15)4-5)11-10(16)6(1-2-20-11)12(17,18)19/h1-4H.
What are the key properties of 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine?
3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine has a molecular weight of 360.98 g/mol, XLogP of 6.38, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine is sourced from PubChem (CID 134636127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).