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

C10H6Cl3N3O — CID 62857422

IUPAC2,4-dichloro-6-(2-chloro-4-methylphenoxy)-1,3,5-triazine
SMILESCc1ccc(Oc2nc(Cl)nc(Cl)n2)c(Cl)c1
InChIInChI=1S/C10H6Cl3N3O/c1-5-2-3-7(6(11)4-5)17-10-15-8(12)14-9(13)16-10/h2-4H,1H3
InChIKeyRLRRQWGCCJBFEY-UHFFFAOYSA-N
MW290.54 g/mol
LogP3.93
Rot. Bonds2

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

2,4-dichloro-6-(2-chloro-4-methylphenoxy)-1,3,5-triazine (PubChem CID 62857422) has the molecular formula C10H6Cl3N3O and a molecular weight of 290.54 g/mol. Its IUPAC name is 2,4-dichloro-6-(2-chloro-4-methylphenoxy)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dichloro-6-(2-chloro-4-methylphenoxy)-1,3,5-triazine
PubChem CID62857422
Molecular FormulaC10H6Cl3N3O
Molecular Weight290.54 g/mol
Exact Mass288.96
IUPAC Name2,4-dichloro-6-(2-chloro-4-methylphenoxy)-1,3,5-triazine
SMILESCc1ccc(Oc2nc(Cl)nc(Cl)n2)c(Cl)c1
InChIInChI=1S/C10H6Cl3N3O/c1-5-2-3-7(6(11)4-5)17-10-15-8(12)14-9(13)16-10/h2-4H,1H3
InChIKeyRLRRQWGCCJBFEY-UHFFFAOYSA-N
XLogP3.93
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.54
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-(2-chloro-4-methylphenoxy)-1,3,5-triazine?
The IUPAC name of 2,4-dichloro-6-(2-chloro-4-methylphenoxy)-1,3,5-triazine (CID 62857422) is 2,4-dichloro-6-(2-chloro-4-methylphenoxy)-1,3,5-triazine.
What is the SMILES notation for 2,4-dichloro-6-(2-chloro-4-methylphenoxy)-1,3,5-triazine?
The canonical SMILES for 2,4-dichloro-6-(2-chloro-4-methylphenoxy)-1,3,5-triazine is Cc1ccc(Oc2nc(Cl)nc(Cl)n2)c(Cl)c1.
What is the InChIKey of 2,4-dichloro-6-(2-chloro-4-methylphenoxy)-1,3,5-triazine?
The InChIKey is RLRRQWGCCJBFEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl3N3O/c1-5-2-3-7(6(11)4-5)17-10-15-8(12)14-9(13)16-10/h2-4H,1H3.
What are the key properties of 2,4-dichloro-6-(2-chloro-4-methylphenoxy)-1,3,5-triazine?
2,4-dichloro-6-(2-chloro-4-methylphenoxy)-1,3,5-triazine has a molecular weight of 290.54 g/mol, XLogP of 3.93, 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-(2-chloro-4-methylphenoxy)-1,3,5-triazine is sourced from PubChem (CID 62857422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).