4-(3,4-dichlorophenyl)-1H-pyridazin-6-one

C10H6Cl2N2O — CID 106516327

IUPAC4-(3,4-dichlorophenyl)-1H-pyridazin-6-one
SMILESO=c1cc(-c2ccc(Cl)c(Cl)c2)cn[nH]1
InChIInChI=1S/C10H6Cl2N2O/c11-8-2-1-6(3-9(8)12)7-4-10(15)14-13-5-7/h1-5H,(H,14,15)
InChIKeyLUHQNMZCSHTRDX-UHFFFAOYSA-N
MW241.08 g/mol
LogP2.74
Rot. Bonds1

About 4-(3,4-dichlorophenyl)-1H-pyridazin-6-one

4-(3,4-dichlorophenyl)-1H-pyridazin-6-one (PubChem CID 106516327) has the molecular formula C10H6Cl2N2O and a molecular weight of 241.08 g/mol. Its IUPAC name is 4-(3,4-dichlorophenyl)-1H-pyridazin-6-one.

Molecular Properties

Compound Name4-(3,4-dichlorophenyl)-1H-pyridazin-6-one
PubChem CID106516327
Molecular FormulaC10H6Cl2N2O
Molecular Weight241.08 g/mol
Exact Mass239.99
IUPAC Name4-(3,4-dichlorophenyl)-1H-pyridazin-6-one
SMILESO=c1cc(-c2ccc(Cl)c(Cl)c2)cn[nH]1
InChIInChI=1S/C10H6Cl2N2O/c11-8-2-1-6(3-9(8)12)7-4-10(15)14-13-5-7/h1-5H,(H,14,15)
InChIKeyLUHQNMZCSHTRDX-UHFFFAOYSA-N
XLogP2.74
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.08
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2,3,4-trichlorophenyl)-1H-pyridazin-6-one
CID 174358567
4-bromo-5-(3,4-dichlorophenyl)-1H-pyrazole
CID 15766316
4-(4-propylphenyl)-1H-pyridazin-6-one
CID 106517178
4-(3-ethoxyphenyl)-1H-pyridazin-6-one
CID 106519861
4-(3-chloro-4-fluorophenyl)-1H-pyridazine-6-thione
CID 106521078
methyl 2-fluoro-4-(6-oxo-1H-pyridazin-4-yl)benzoate
CID 122590621
4-(2-hydroxyphenyl)-1H-pyridazin-6-one
CID 56927406
5-(3,4-dichlorophenyl)-1H-indole-2,3-dione
CID 16768769
1,2-dichloro-4-[3-chloro-5-(3,4-dichlorophenyl)phenyl]benzene
CID 129318156
5-(3,4-dichlorophenyl)-1H-1,2,4-triazole
CID 58503677
3-(3,4-dichlorophenyl)-6-methyl-1H-pyridin-2-one
CID 133092861
4-(1-propan-2-ylpyrazol-3-yl)-1H-pyridazin-6-one
CID 154869277

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dichlorophenyl)-1H-pyridazin-6-one?
The IUPAC name of 4-(3,4-dichlorophenyl)-1H-pyridazin-6-one (CID 106516327) is 4-(3,4-dichlorophenyl)-1H-pyridazin-6-one.
What is the SMILES notation for 4-(3,4-dichlorophenyl)-1H-pyridazin-6-one?
The canonical SMILES for 4-(3,4-dichlorophenyl)-1H-pyridazin-6-one is O=c1cc(-c2ccc(Cl)c(Cl)c2)cn[nH]1.
What is the InChIKey of 4-(3,4-dichlorophenyl)-1H-pyridazin-6-one?
The InChIKey is LUHQNMZCSHTRDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2N2O/c11-8-2-1-6(3-9(8)12)7-4-10(15)14-13-5-7/h1-5H,(H,14,15).
What are the key properties of 4-(3,4-dichlorophenyl)-1H-pyridazin-6-one?
4-(3,4-dichlorophenyl)-1H-pyridazin-6-one has a molecular weight of 241.08 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dichlorophenyl)-1H-pyridazin-6-one is sourced from PubChem (CID 106516327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).