2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine

C5H2F5N3O — CID 171774630

IUPAC2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine
SMILESFc1nc(F)nc(OCC(F)(F)F)n1
InChIInChI=1S/C5H2F5N3O/c6-2-11-3(7)13-4(12-2)14-1-5(8,9)10/h1H2
InChIKeyAZCDOUNOCLPURY-UHFFFAOYSA-N
MW215.08 g/mol
LogP1.09
Rot. Bonds2

About 2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine

2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine (PubChem CID 171774630) has the molecular formula C5H2F5N3O and a molecular weight of 215.08 g/mol. Its IUPAC name is 2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine
PubChem CID171774630
Molecular FormulaC5H2F5N3O
Molecular Weight215.08 g/mol
Exact Mass215.01
IUPAC Name2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine
SMILESFc1nc(F)nc(OCC(F)(F)F)n1
InChIInChI=1S/C5H2F5N3O/c6-2-11-3(7)13-4(12-2)14-1-5(8,9)10/h1H2
InChIKeyAZCDOUNOCLPURY-UHFFFAOYSA-N
XLogP1.09
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.08
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine
CID 139595246
4,6-Bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
CID 1375552
2,4,6-Tris(2,2,2-trifluoroethoxy)-1,3,5-triazine
CID 3091708
2-Chloro-4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazine
CID 53342808
2,4,6-Tris(2,2,3,3,3-pentafluoropropoxy)-1,3,5-triazine
CID 12586979
1,3,5-Triazin-2-amine, 4-methoxy-6-(2,2,2-trifluoroethoxy)-
CID 180958
2,4,6-Tris[1-(trifluoromethyl)-2,2,2-trifluoroethoxy]-1,3,5-triazine
CID 2827226
2-Amino-4-ethoxy-6-trifluoromethoxy-1,3,5-triazine
CID 15010395
2-Ethoxy-4,6-difluoro-1,3,5-triazine
CID 20403084
2,4-Dichloro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine
CID 58039636
2,4-Dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine
CID 62859410
2,4-Dichloro-6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine
CID 87242005

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine?
The IUPAC name of 2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine (CID 171774630) is 2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine.
What is the SMILES notation for 2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine?
The canonical SMILES for 2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine is Fc1nc(F)nc(OCC(F)(F)F)n1.
What is the InChIKey of 2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine?
The InChIKey is AZCDOUNOCLPURY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2F5N3O/c6-2-11-3(7)13-4(12-2)14-1-5(8,9)10/h1H2.
What are the key properties of 2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine?
2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine has a molecular weight of 215.08 g/mol, XLogP of 1.09, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine is sourced from PubChem (CID 171774630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).