2,4-dichloro-1,3,5-triazine;hydrofluoride

C3H2Cl2FN3 — CID 159984143

IUPAC2,4-dichloro-1,3,5-triazine;hydrofluoride
SMILESClc1ncnc(Cl)n1.F
InChIInChI=1S/C3HCl2N3.FH/c4-2-6-1-7-3(5)8-2;/h1H;1H
InChIKeyMKROSHJSAHDRSC-UHFFFAOYSA-N
MW169.97 g/mol
LogP1.33
Rot. Bonds

About 2,4-dichloro-1,3,5-triazine;hydrofluoride

2,4-dichloro-1,3,5-triazine;hydrofluoride (PubChem CID 159984143) has the molecular formula C3H2Cl2FN3 and a molecular weight of 169.97 g/mol. Its IUPAC name is 2,4-dichloro-1,3,5-triazine;hydrofluoride.

Molecular Properties

Compound Name2,4-dichloro-1,3,5-triazine;hydrofluoride
PubChem CID159984143
Molecular FormulaC3H2Cl2FN3
Molecular Weight169.97 g/mol
Exact Mass168.96
IUPAC Name2,4-dichloro-1,3,5-triazine;hydrofluoride
SMILESClc1ncnc(Cl)n1.F
InChIInChI=1S/C3HCl2N3.FH/c4-2-6-1-7-3(5)8-2;/h1H;1H
InChIKeyMKROSHJSAHDRSC-UHFFFAOYSA-N
XLogP1.33
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.97
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-1,3,5-triazine;hydrofluoride?
The IUPAC name of 2,4-dichloro-1,3,5-triazine;hydrofluoride (CID 159984143) is 2,4-dichloro-1,3,5-triazine;hydrofluoride.
What is the SMILES notation for 2,4-dichloro-1,3,5-triazine;hydrofluoride?
The canonical SMILES for 2,4-dichloro-1,3,5-triazine;hydrofluoride is Clc1ncnc(Cl)n1.F.
What is the InChIKey of 2,4-dichloro-1,3,5-triazine;hydrofluoride?
The InChIKey is MKROSHJSAHDRSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3HCl2N3.FH/c4-2-6-1-7-3(5)8-2;/h1H;1H.
What are the key properties of 2,4-dichloro-1,3,5-triazine;hydrofluoride?
2,4-dichloro-1,3,5-triazine;hydrofluoride has a molecular weight of 169.97 g/mol, XLogP of 1.33, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-1,3,5-triazine;hydrofluoride is sourced from PubChem (CID 159984143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).