2,4,6-tris(trifluoromethyl)-1,3,5-triazine

C6F9N3 — CID 9715

IUPAC2,4,6-tris(trifluoromethyl)-1,3,5-triazine
SMILESFC(F)(F)c1nc(C(F)(F)F)nc(C(F)(F)F)n1
InChIInChI=1S/C6F9N3/c7-4(8,9)1-16-2(5(10,11)12)18-3(17-1)6(13,14)15
InChIKeyLSGBKABSSSIRJF-UHFFFAOYSA-N
MW285.07 g/mol
LogP2.93
Rot. Bonds

About 2,4,6-tris(trifluoromethyl)-1,3,5-triazine

2,4,6-tris(trifluoromethyl)-1,3,5-triazine (PubChem CID 9715) has the molecular formula C6F9N3 and a molecular weight of 285.07 g/mol. Its IUPAC name is 2,4,6-tris(trifluoromethyl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4,6-tris(trifluoromethyl)-1,3,5-triazine
PubChem CID9715
Molecular FormulaC6F9N3
Molecular Weight285.07 g/mol
Exact Mass284.99
IUPAC Name2,4,6-tris(trifluoromethyl)-1,3,5-triazine
SMILESFC(F)(F)c1nc(C(F)(F)F)nc(C(F)(F)F)n1
InChIInChI=1S/C6F9N3/c7-4(8,9)1-16-2(5(10,11)12)18-3(17-1)6(13,14)15
InChIKeyLSGBKABSSSIRJF-UHFFFAOYSA-N
XLogP2.93
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.07
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4,6-tris(trifluoromethyl)-1,3,5-triazine?
The IUPAC name of 2,4,6-tris(trifluoromethyl)-1,3,5-triazine (CID 9715) is 2,4,6-tris(trifluoromethyl)-1,3,5-triazine.
What is the SMILES notation for 2,4,6-tris(trifluoromethyl)-1,3,5-triazine?
The canonical SMILES for 2,4,6-tris(trifluoromethyl)-1,3,5-triazine is FC(F)(F)c1nc(C(F)(F)F)nc(C(F)(F)F)n1.
What is the InChIKey of 2,4,6-tris(trifluoromethyl)-1,3,5-triazine?
The InChIKey is LSGBKABSSSIRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6F9N3/c7-4(8,9)1-16-2(5(10,11)12)18-3(17-1)6(13,14)15.
What are the key properties of 2,4,6-tris(trifluoromethyl)-1,3,5-triazine?
2,4,6-tris(trifluoromethyl)-1,3,5-triazine has a molecular weight of 285.07 g/mol, XLogP of 2.93, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-tris(trifluoromethyl)-1,3,5-triazine is sourced from PubChem (CID 9715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).