2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine

C9H11Cl2NO2 — CID 119088450

IUPAC2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine
SMILESCOCCOCc1cc(Cl)nc(Cl)c1
InChIInChI=1S/C9H11Cl2NO2/c1-13-2-3-14-6-7-4-8(10)12-9(11)5-7/h4-5H,2-3,6H2,1H3
InChIKeyGVLDUQGCCMHBNH-UHFFFAOYSA-N
MW236.10 g/mol
LogP2.55
Rot. Bonds5

About 2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine

2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine (PubChem CID 119088450) has the molecular formula C9H11Cl2NO2 and a molecular weight of 236.10 g/mol. Its IUPAC name is 2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine.

Molecular Properties

Compound Name2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine
PubChem CID119088450
Molecular FormulaC9H11Cl2NO2
Molecular Weight236.10 g/mol
Exact Mass235.02
IUPAC Name2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine
SMILESCOCCOCc1cc(Cl)nc(Cl)c1
InChIInChI=1S/C9H11Cl2NO2/c1-13-2-3-14-6-7-4-8(10)12-9(11)5-7/h4-5H,2-3,6H2,1H3
InChIKeyGVLDUQGCCMHBNH-UHFFFAOYSA-N
XLogP2.55
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.10
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine?
The IUPAC name of 2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine (CID 119088450) is 2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine.
What is the SMILES notation for 2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine?
The canonical SMILES for 2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine is COCCOCc1cc(Cl)nc(Cl)c1.
What is the InChIKey of 2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine?
The InChIKey is GVLDUQGCCMHBNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11Cl2NO2/c1-13-2-3-14-6-7-4-8(10)12-9(11)5-7/h4-5H,2-3,6H2,1H3.
What are the key properties of 2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine?
2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine has a molecular weight of 236.10 g/mol, XLogP of 2.55, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-4-(2-methoxyethoxymethyl)pyridine is sourced from PubChem (CID 119088450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).