3,6-dichloro-4-phenylpyridazine

C10H6Cl2N2 — CID 11322080

IUPAC3,6-dichloro-4-phenylpyridazine
SMILESClc1cc(-c2ccccc2)c(Cl)nn1
InChIInChI=1S/C10H6Cl2N2/c11-9-6-8(10(12)14-13-9)7-4-2-1-3-5-7/h1-6H
InChIKeyQEANUHPTLLPFPA-UHFFFAOYSA-N
MW225.08 g/mol
LogP3.45
Rot. Bonds1

About 3,6-dichloro-4-phenylpyridazine

3,6-dichloro-4-phenylpyridazine (PubChem CID 11322080) has the molecular formula C10H6Cl2N2 and a molecular weight of 225.08 g/mol. Its IUPAC name is 3,6-dichloro-4-phenylpyridazine.

Molecular Properties

Compound Name3,6-dichloro-4-phenylpyridazine
PubChem CID11322080
Molecular FormulaC10H6Cl2N2
Molecular Weight225.08 g/mol
Exact Mass223.99
IUPAC Name3,6-dichloro-4-phenylpyridazine
SMILESClc1cc(-c2ccccc2)c(Cl)nn1
InChIInChI=1S/C10H6Cl2N2/c11-9-6-8(10(12)14-13-9)7-4-2-1-3-5-7/h1-6H
InChIKeyQEANUHPTLLPFPA-UHFFFAOYSA-N
XLogP3.45
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.08
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-Dichlorophthalazine
CID 78490
3-Chloro-6-phenylpyridazine
CID 88515
2-(6-Chloro-3-pyridazinyl)-2-(2,4-dichlorophenyl)acetonitrile
CID 5706842
(6-Chloropyridazin-3-yl)(3-methylphenyl)acetonitrile
CID 6409738
3-Chloro-6-(2-methylbenzyl)pyridazine
CID 6404653
3-Benzyl-6-chloropyridazine
CID 6404535
3-Chloro-5H-indeno(1,2-c)pyridazine
CID 100610
(6-Chloropyridazin-3-yl)(4-methylphenyl)acetonitrile
CID 2764222
3-Chlorocinnoline
CID 11194524
(6-Chloropyridazin-3-yl)(phenyl)acetonitrile
CID 5706838
3-Chloro-6-(4-methylphenyl)pyridazine
CID 2775558
2-(4-Chlorophenyl)-2-(6-chloropyridazin-3-yl)acetonitrile
CID 6413172

Frequently Asked Questions

What is the IUPAC name of 3,6-dichloro-4-phenylpyridazine?
The IUPAC name of 3,6-dichloro-4-phenylpyridazine (CID 11322080) is 3,6-dichloro-4-phenylpyridazine.
What is the SMILES notation for 3,6-dichloro-4-phenylpyridazine?
The canonical SMILES for 3,6-dichloro-4-phenylpyridazine is Clc1cc(-c2ccccc2)c(Cl)nn1.
What is the InChIKey of 3,6-dichloro-4-phenylpyridazine?
The InChIKey is QEANUHPTLLPFPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2N2/c11-9-6-8(10(12)14-13-9)7-4-2-1-3-5-7/h1-6H.
What are the key properties of 3,6-dichloro-4-phenylpyridazine?
3,6-dichloro-4-phenylpyridazine has a molecular weight of 225.08 g/mol, XLogP of 3.45, 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-phenylpyridazine is sourced from PubChem (CID 11322080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).