4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine

C7H2Cl2F5N — CID 118846674

IUPAC4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine
SMILESFC(F)c1c(Cl)cc(Cl)nc1C(F)(F)F
InChIInChI=1S/C7H2Cl2F5N/c8-2-1-3(9)15-5(7(12,13)14)4(2)6(10)11/h1,6H
InChIKeySBQISZLDZNPQPO-UHFFFAOYSA-N
MW266.00 g/mol
LogP4.34
Rot. Bonds1

About 4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine

4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine (PubChem CID 118846674) has the molecular formula C7H2Cl2F5N and a molecular weight of 266.00 g/mol. Its IUPAC name is 4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine
PubChem CID118846674
Molecular FormulaC7H2Cl2F5N
Molecular Weight266.00 g/mol
Exact Mass264.95
IUPAC Name4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine
SMILESFC(F)c1c(Cl)cc(Cl)nc1C(F)(F)F
InChIInChI=1S/C7H2Cl2F5N/c8-2-1-3(9)15-5(7(12,13)14)4(2)6(10)11/h1,6H
InChIKeySBQISZLDZNPQPO-UHFFFAOYSA-N
XLogP4.34
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.00
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3,4,6-trichloro-2-(trifluoromethyl)pyridine
CID 171506095
[4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol
CID 118839527
6-chloro-4-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine
CID 130102782
6-chloro-4-(difluoromethyl)-3-methoxy-2-(trifluoromethyl)pyridine
CID 130073838
1,3-dichloro-2-(difluoromethyl)-5-(trifluoromethyl)benzene
CID 171009487
[4,6-dichloro-3-(difluoromethyl)-2-pyridinyl]methanol
CID 118806568
5-chloro-2-(difluoromethyl)-3-fluoro-6-(trifluoromethyl)pyridine
CID 134685820
6-chloro-3-(difluoromethyl)-4-(trifluoromethyl)pyridine-2-carbaldehyde
CID 130075823
6-bromo-3-(difluoromethyl)-4-methyl-2-(trifluoromethyl)pyridine
CID 130069265
3-(difluoromethyl)-4-iodo-6-methyl-2-(trifluoromethyl)pyridine
CID 130086110
3-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridine
CID 130095577
2-chloro-6-(difluoromethyl)-4-(trifluoromethyl)pyridine
CID 119003399

Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine?
The IUPAC name of 4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine (CID 118846674) is 4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine.
What is the SMILES notation for 4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine?
The canonical SMILES for 4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine is FC(F)c1c(Cl)cc(Cl)nc1C(F)(F)F.
What is the InChIKey of 4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine?
The InChIKey is SBQISZLDZNPQPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H2Cl2F5N/c8-2-1-3(9)15-5(7(12,13)14)4(2)6(10)11/h1,6H.
What are the key properties of 4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine?
4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine has a molecular weight of 266.00 g/mol, XLogP of 4.34, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 118846674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).