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

C6H3Cl2F4N3O — CID 62859410

IUPAC2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine
SMILESFC(F)C(F)(F)COc1nc(Cl)nc(Cl)n1
InChIInChI=1S/C6H3Cl2F4N3O/c7-3-13-4(8)15-5(14-3)16-1-6(11,12)2(9)10/h2H,1H2
InChIKeyHDPAYFVFXNBPGZ-UHFFFAOYSA-N
MW280.01 g/mol
LogP2.46
Rot. Bonds4

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

2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine (PubChem CID 62859410) has the molecular formula C6H3Cl2F4N3O and a molecular weight of 280.01 g/mol. Its IUPAC name is 2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine
PubChem CID62859410
Molecular FormulaC6H3Cl2F4N3O
Molecular Weight280.01 g/mol
Exact Mass278.96
IUPAC Name2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine
SMILESFC(F)C(F)(F)COc1nc(Cl)nc(Cl)n1
InChIInChI=1S/C6H3Cl2F4N3O/c7-3-13-4(8)15-5(14-3)16-1-6(11,12)2(9)10/h2H,1H2
InChIKeyHDPAYFVFXNBPGZ-UHFFFAOYSA-N
XLogP2.46
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.01
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine?
The IUPAC name of 2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine (CID 62859410) is 2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine.
What is the SMILES notation for 2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine?
The canonical SMILES for 2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine is FC(F)C(F)(F)COc1nc(Cl)nc(Cl)n1.
What is the InChIKey of 2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine?
The InChIKey is HDPAYFVFXNBPGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3Cl2F4N3O/c7-3-13-4(8)15-5(14-3)16-1-6(11,12)2(9)10/h2H,1H2.
What are the key properties of 2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine?
2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine has a molecular weight of 280.01 g/mol, XLogP of 2.46, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine is sourced from PubChem (CID 62859410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).