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

C6H7Cl2N3O2 — CID 19026146

IUPAC2,4-dichloro-6-(2-methoxyethoxy)-1,3,5-triazine
SMILESCOCCOc1nc(Cl)nc(Cl)n1
InChIInChI=1S/C6H7Cl2N3O2/c1-12-2-3-13-6-10-4(7)9-5(8)11-6/h2-3H2,1H3
InChIKeyWZNXZGUADKCAMB-UHFFFAOYSA-N
MW224.05 g/mol
LogP1.20
Rot. Bonds4

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

2,4-dichloro-6-(2-methoxyethoxy)-1,3,5-triazine (PubChem CID 19026146) has the molecular formula C6H7Cl2N3O2 and a molecular weight of 224.05 g/mol. Its IUPAC name is 2,4-dichloro-6-(2-methoxyethoxy)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dichloro-6-(2-methoxyethoxy)-1,3,5-triazine
PubChem CID19026146
Molecular FormulaC6H7Cl2N3O2
Molecular Weight224.05 g/mol
Exact Mass222.99
IUPAC Name2,4-dichloro-6-(2-methoxyethoxy)-1,3,5-triazine
SMILESCOCCOc1nc(Cl)nc(Cl)n1
InChIInChI=1S/C6H7Cl2N3O2/c1-12-2-3-13-6-10-4(7)9-5(8)11-6/h2-3H2,1H3
InChIKeyWZNXZGUADKCAMB-UHFFFAOYSA-N
XLogP1.20
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.05
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-(2-methoxyethoxy)-1,3,5-triazine?
The IUPAC name of 2,4-dichloro-6-(2-methoxyethoxy)-1,3,5-triazine (CID 19026146) is 2,4-dichloro-6-(2-methoxyethoxy)-1,3,5-triazine.
What is the SMILES notation for 2,4-dichloro-6-(2-methoxyethoxy)-1,3,5-triazine?
The canonical SMILES for 2,4-dichloro-6-(2-methoxyethoxy)-1,3,5-triazine is COCCOc1nc(Cl)nc(Cl)n1.
What is the InChIKey of 2,4-dichloro-6-(2-methoxyethoxy)-1,3,5-triazine?
The InChIKey is WZNXZGUADKCAMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7Cl2N3O2/c1-12-2-3-13-6-10-4(7)9-5(8)11-6/h2-3H2,1H3.
What are the key properties of 2,4-dichloro-6-(2-methoxyethoxy)-1,3,5-triazine?
2,4-dichloro-6-(2-methoxyethoxy)-1,3,5-triazine has a molecular weight of 224.05 g/mol, XLogP of 1.20, 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-methoxyethoxy)-1,3,5-triazine is sourced from PubChem (CID 19026146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).