3,6-bis(4-chlorophenyl)pyridazine

C16H10Cl2N2 — CID 11197367

IUPAC3,6-bis(4-chlorophenyl)pyridazine
SMILESClc1ccc(-c2ccc(-c3ccc(Cl)cc3)nn2)cc1
InChIInChI=1S/C16H10Cl2N2/c17-13-5-1-11(2-6-13)15-9-10-16(20-19-15)12-3-7-14(18)8-4-12/h1-10H
InChIKeyYELRZIAPSFRKQG-UHFFFAOYSA-N
MW301.18 g/mol
LogP5.12
Rot. Bonds2

About 3,6-bis(4-chlorophenyl)pyridazine

3,6-bis(4-chlorophenyl)pyridazine (PubChem CID 11197367) has the molecular formula C16H10Cl2N2 and a molecular weight of 301.18 g/mol. Its IUPAC name is 3,6-bis(4-chlorophenyl)pyridazine.

Molecular Properties

Compound Name3,6-bis(4-chlorophenyl)pyridazine
PubChem CID11197367
Molecular FormulaC16H10Cl2N2
Molecular Weight301.18 g/mol
Exact Mass300.02
IUPAC Name3,6-bis(4-chlorophenyl)pyridazine
SMILESClc1ccc(-c2ccc(-c3ccc(Cl)cc3)nn2)cc1
InChIInChI=1S/C16H10Cl2N2/c17-13-5-1-11(2-6-13)15-9-10-16(20-19-15)12-3-7-14(18)8-4-12/h1-10H
InChIKeyYELRZIAPSFRKQG-UHFFFAOYSA-N
XLogP5.12
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.18
LogP ≤ 55.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,6-bis(4-chlorophenyl)pyridazine?
The IUPAC name of 3,6-bis(4-chlorophenyl)pyridazine (CID 11197367) is 3,6-bis(4-chlorophenyl)pyridazine.
What is the SMILES notation for 3,6-bis(4-chlorophenyl)pyridazine?
The canonical SMILES for 3,6-bis(4-chlorophenyl)pyridazine is Clc1ccc(-c2ccc(-c3ccc(Cl)cc3)nn2)cc1.
What is the InChIKey of 3,6-bis(4-chlorophenyl)pyridazine?
The InChIKey is YELRZIAPSFRKQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2N2/c17-13-5-1-11(2-6-13)15-9-10-16(20-19-15)12-3-7-14(18)8-4-12/h1-10H.
What are the key properties of 3,6-bis(4-chlorophenyl)pyridazine?
3,6-bis(4-chlorophenyl)pyridazine has a molecular weight of 301.18 g/mol, XLogP of 5.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-bis(4-chlorophenyl)pyridazine is sourced from PubChem (CID 11197367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).