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

C7H3F6N3 — CID 154133260

IUPAC2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine
SMILESC=Cc1nc(C(F)(F)F)nc(C(F)(F)F)n1
InChIInChI=1S/C7H3F6N3/c1-2-3-14-4(6(8,9)10)16-5(15-3)7(11,12)13/h2H,1H2
InChIKeyYAWDMEVVRIDPIL-UHFFFAOYSA-N
MW243.11 g/mol
LogP2.55
Rot. Bonds1

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

2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine (PubChem CID 154133260) has the molecular formula C7H3F6N3 and a molecular weight of 243.11 g/mol. Its IUPAC name is 2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine
PubChem CID154133260
Molecular FormulaC7H3F6N3
Molecular Weight243.11 g/mol
Exact Mass243.02
IUPAC Name2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine
SMILESC=Cc1nc(C(F)(F)F)nc(C(F)(F)F)n1
InChIInChI=1S/C7H3F6N3/c1-2-3-14-4(6(8,9)10)16-5(15-3)7(11,12)13/h2H,1H2
InChIKeyYAWDMEVVRIDPIL-UHFFFAOYSA-N
XLogP2.55
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.11
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine?
The IUPAC name of 2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine (CID 154133260) is 2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine.
What is the SMILES notation for 2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine?
The canonical SMILES for 2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine is C=Cc1nc(C(F)(F)F)nc(C(F)(F)F)n1.
What is the InChIKey of 2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine?
The InChIKey is YAWDMEVVRIDPIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3F6N3/c1-2-3-14-4(6(8,9)10)16-5(15-3)7(11,12)13/h2H,1H2.
What are the key properties of 2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine?
2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine has a molecular weight of 243.11 g/mol, XLogP of 2.55, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-4,6-bis(trifluoromethyl)-1,3,5-triazine is sourced from PubChem (CID 154133260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).