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

C11H9Cl2N3O2 — CID 62858074

IUPAC2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine
SMILESCCOc1ccccc1Oc1nc(Cl)nc(Cl)n1
InChIInChI=1S/C11H9Cl2N3O2/c1-2-17-7-5-3-4-6-8(7)18-11-15-9(12)14-10(13)16-11/h3-6H,2H2,1H3
InChIKeyCQHCRFPNQITKHH-UHFFFAOYSA-N
MW286.12 g/mol
LogP3.37
Rot. Bonds4

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

2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine (PubChem CID 62858074) has the molecular formula C11H9Cl2N3O2 and a molecular weight of 286.12 g/mol. Its IUPAC name is 2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine
PubChem CID62858074
Molecular FormulaC11H9Cl2N3O2
Molecular Weight286.12 g/mol
Exact Mass285.01
IUPAC Name2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine
SMILESCCOc1ccccc1Oc1nc(Cl)nc(Cl)n1
InChIInChI=1S/C11H9Cl2N3O2/c1-2-17-7-5-3-4-6-8(7)18-11-15-9(12)14-10(13)16-11/h3-6H,2H2,1H3
InChIKeyCQHCRFPNQITKHH-UHFFFAOYSA-N
XLogP3.37
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.12
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine?
The IUPAC name of 2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine (CID 62858074) is 2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine.
What is the SMILES notation for 2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine?
The canonical SMILES for 2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine is CCOc1ccccc1Oc1nc(Cl)nc(Cl)n1.
What is the InChIKey of 2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine?
The InChIKey is CQHCRFPNQITKHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Cl2N3O2/c1-2-17-7-5-3-4-6-8(7)18-11-15-9(12)14-10(13)16-11/h3-6H,2H2,1H3.
What are the key properties of 2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine?
2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine has a molecular weight of 286.12 g/mol, XLogP of 3.37, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine is sourced from PubChem (CID 62858074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).