2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine

C6H4Cl2F3N3O — CID 66275882

IUPAC2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine
SMILESCC(Oc1nc(Cl)nc(Cl)n1)C(F)(F)F
InChIInChI=1S/C6H4Cl2F3N3O/c1-2(6(9,10)11)15-5-13-3(7)12-4(8)14-5/h2H,1H3
InChIKeyFYHIBBHFEVBDPL-UHFFFAOYSA-N
MW262.02 g/mol
LogP2.51
Rot. Bonds2

About 2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine

2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine (PubChem CID 66275882) has the molecular formula C6H4Cl2F3N3O and a molecular weight of 262.02 g/mol. Its IUPAC name is 2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine
PubChem CID66275882
Molecular FormulaC6H4Cl2F3N3O
Molecular Weight262.02 g/mol
Exact Mass260.97
IUPAC Name2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine
SMILESCC(Oc1nc(Cl)nc(Cl)n1)C(F)(F)F
InChIInChI=1S/C6H4Cl2F3N3O/c1-2(6(9,10)11)15-5-13-3(7)12-4(8)14-5/h2H,1H3
InChIKeyFYHIBBHFEVBDPL-UHFFFAOYSA-N
XLogP2.51
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.02
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-Dichloro-6-isopropoxy-1,3,5-triazine
CID 23154
2,4-Dichloro-6-ethoxy-1,3,5-triazine
CID 29035
2,4-Dichloro-6-propoxy-1,3,5-triazine
CID 33570
2-Chloro-4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazine
CID 53342808
2,4-Difluoro-6-propan-2-yloxy-1,3,5-triazine
CID 20034770
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-(1,1,1,2,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine
CID 87242004
2,4-Dichloro-6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine
CID 87242005
2-Chloro-4,6-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine
CID 87242007
2-Chloro-4-propan-2-yloxy-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine
CID 55124240

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine?
The IUPAC name of 2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine (CID 66275882) is 2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine.
What is the SMILES notation for 2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine?
The canonical SMILES for 2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine is CC(Oc1nc(Cl)nc(Cl)n1)C(F)(F)F.
What is the InChIKey of 2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine?
The InChIKey is FYHIBBHFEVBDPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Cl2F3N3O/c1-2(6(9,10)11)15-5-13-3(7)12-4(8)14-5/h2H,1H3.
What are the key properties of 2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine?
2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine has a molecular weight of 262.02 g/mol, XLogP of 2.51, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazine is sourced from PubChem (CID 66275882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).