2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine

C6H3F6N3O — CID 87242130

IUPAC2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine
SMILESFC(F)(F)C(Oc1ncncn1)C(F)(F)F
InChIInChI=1S/C6H3F6N3O/c7-5(8,9)3(6(10,11)12)16-4-14-1-13-2-15-4/h1-3H
InChIKeyIRCSVPKAAMNTFS-UHFFFAOYSA-N
MW247.10 g/mol
LogP1.74
Rot. Bonds2

About 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine

2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine (PubChem CID 87242130) has the molecular formula C6H3F6N3O and a molecular weight of 247.10 g/mol. Its IUPAC name is 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine.

Molecular Properties

Compound Name2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine
PubChem CID87242130
Molecular FormulaC6H3F6N3O
Molecular Weight247.10 g/mol
Exact Mass247.02
IUPAC Name2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine
SMILESFC(F)(F)C(Oc1ncncn1)C(F)(F)F
InChIInChI=1S/C6H3F6N3O/c7-5(8,9)3(6(10,11)12)16-4-14-1-13-2-15-4/h1-3H
InChIKeyIRCSVPKAAMNTFS-UHFFFAOYSA-N
XLogP1.74
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.10
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine?
The IUPAC name of 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine (CID 87242130) is 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine.
What is the SMILES notation for 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine?
The canonical SMILES for 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine is FC(F)(F)C(Oc1ncncn1)C(F)(F)F.
What is the InChIKey of 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine?
The InChIKey is IRCSVPKAAMNTFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3F6N3O/c7-5(8,9)3(6(10,11)12)16-4-14-1-13-2-15-4/h1-3H.
What are the key properties of 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine?
2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine has a molecular weight of 247.10 g/mol, XLogP of 1.74, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine is sourced from PubChem (CID 87242130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).