2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol

C12H10Cl2N2O — CID 105100348

IUPAC2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol
SMILESOC(Cc1cc(Cl)ccc1Cl)c1ccnnc1
InChIInChI=1S/C12H10Cl2N2O/c13-10-1-2-11(14)9(5-10)6-12(17)8-3-4-15-16-7-8/h1-5,7,12,17H,6H2
InChIKeyGEQHHBLMIWPUDF-UHFFFAOYSA-N
MW269.13 g/mol
LogP3.06
Rot. Bonds3

About 2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol

2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol (PubChem CID 105100348) has the molecular formula C12H10Cl2N2O and a molecular weight of 269.13 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol
PubChem CID105100348
Molecular FormulaC12H10Cl2N2O
Molecular Weight269.13 g/mol
Exact Mass268.02
IUPAC Name2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol
SMILESOC(Cc1cc(Cl)ccc1Cl)c1ccnnc1
InChIInChI=1S/C12H10Cl2N2O/c13-10-1-2-11(14)9(5-10)6-12(17)8-3-4-15-16-7-8/h1-5,7,12,17H,6H2
InChIKeyGEQHHBLMIWPUDF-UHFFFAOYSA-N
XLogP3.06
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.13
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-chlorophenyl)-2-(2,5-dichlorophenyl)ethanol
CID 65316618
2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethanol
CID 65316811
2-(2,5-difluorophenyl)-1-pyridazin-4-ylethanol
CID 105081030
2-(2,5-dichlorophenyl)-1-(4-methylphenyl)ethanol
CID 65316953
2-(2,5-dichlorophenyl)-1-(4-iodophenyl)ethanol
CID 115802046
1-(3-bromo-4-chlorophenyl)-2-(2,5-dichlorophenyl)ethanol
CID 115566546
2-(5-chloro-2-fluorophenyl)-1-pyridin-4-ylethanol
CID 103047540
2-(2,5-dichlorophenyl)-1-naphthalen-2-ylethanol
CID 65317190
2-(5-chloro-2-fluorophenyl)-1-(6-chloro-3-pyridinyl)ethanol
CID 103048307
2-(2-chloro-5-fluorophenyl)-1-pyridin-4-ylethanol
CID 102617218
2-(2,6-dimethylphenyl)-1-pyridazin-4-ylethanol
CID 105120710
1-(5-amino-1H-pyrazol-4-yl)-2-(2,5-dichlorophenyl)ethanol
CID 65362046

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol?
The IUPAC name of 2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol (CID 105100348) is 2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol?
The canonical SMILES for 2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol is OC(Cc1cc(Cl)ccc1Cl)c1ccnnc1.
What is the InChIKey of 2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol?
The InChIKey is GEQHHBLMIWPUDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2N2O/c13-10-1-2-11(14)9(5-10)6-12(17)8-3-4-15-16-7-8/h1-5,7,12,17H,6H2.
What are the key properties of 2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol?
2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol has a molecular weight of 269.13 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol is sourced from PubChem (CID 105100348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).