3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine

C10H11Cl3N2 — CID 14349834

IUPAC3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine
SMILESClc1cc(C2CCCCC2Cl)c(Cl)nn1
InChIInChI=1S/C10H11Cl3N2/c11-8-4-2-1-3-6(8)7-5-9(12)14-15-10(7)13/h5-6,8H,1-4H2
InChIKeyFCBWNDLAFMXROS-UHFFFAOYSA-N
MW265.57 g/mol
LogP4.05
Rot. Bonds1

About 3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine

3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine (PubChem CID 14349834) has the molecular formula C10H11Cl3N2 and a molecular weight of 265.57 g/mol. Its IUPAC name is 3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine.

Molecular Properties

Compound Name3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine
PubChem CID14349834
Molecular FormulaC10H11Cl3N2
Molecular Weight265.57 g/mol
Exact Mass264.00
IUPAC Name3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine
SMILESClc1cc(C2CCCCC2Cl)c(Cl)nn1
InChIInChI=1S/C10H11Cl3N2/c11-8-4-2-1-3-6(8)7-5-9(12)14-15-10(7)13/h5-6,8H,1-4H2
InChIKeyFCBWNDLAFMXROS-UHFFFAOYSA-N
XLogP4.05
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.57
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine?
The IUPAC name of 3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine (CID 14349834) is 3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine.
What is the SMILES notation for 3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine?
The canonical SMILES for 3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine is Clc1cc(C2CCCCC2Cl)c(Cl)nn1.
What is the InChIKey of 3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine?
The InChIKey is FCBWNDLAFMXROS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Cl3N2/c11-8-4-2-1-3-6(8)7-5-9(12)14-15-10(7)13/h5-6,8H,1-4H2.
What are the key properties of 3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine?
3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine has a molecular weight of 265.57 g/mol, XLogP of 4.05, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dichloro-4-(2-chlorocyclohexyl)pyridazine is sourced from PubChem (CID 14349834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).