3,6-dichloro-4-propan-2-ylpyridazine

C7H8Cl2N2 — CID 14024162

IUPAC3,6-dichloro-4-propan-2-ylpyridazine
SMILESCC(C)c1cc(Cl)nnc1Cl
InChIInChI=1S/C7H8Cl2N2/c1-4(2)5-3-6(8)10-11-7(5)9/h3-4H,1-2H3
InChIKeyJRZDBBCBIQEJLA-UHFFFAOYSA-N
MW191.06 g/mol
LogP2.91
Rot. Bonds1

About 3,6-dichloro-4-propan-2-ylpyridazine

3,6-dichloro-4-propan-2-ylpyridazine (PubChem CID 14024162) has the molecular formula C7H8Cl2N2 and a molecular weight of 191.06 g/mol. Its IUPAC name is 3,6-dichloro-4-propan-2-ylpyridazine.

Molecular Properties

Compound Name3,6-dichloro-4-propan-2-ylpyridazine
PubChem CID14024162
Molecular FormulaC7H8Cl2N2
Molecular Weight191.06 g/mol
Exact Mass190.01
IUPAC Name3,6-dichloro-4-propan-2-ylpyridazine
SMILESCC(C)c1cc(Cl)nnc1Cl
InChIInChI=1S/C7H8Cl2N2/c1-4(2)5-3-6(8)10-11-7(5)9/h3-4H,1-2H3
InChIKeyJRZDBBCBIQEJLA-UHFFFAOYSA-N
XLogP2.91
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.06
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-tert-Butyl-3,6-dichloropyridazine
CID 89846
Pyridazine, 3,6-dichloro-4-(2-chloro-1,1-dimethylethyl)-
CID 163783
Pyridazine, 4-(2-bromo-1,1-dimethylethyl)-3,6-dichloro-
CID 163784
6-Chloro-3,4-dimethylpyridazine
CID 51341969
6-Chloro-3-(chloromethyl)-4-methylpyridazine
CID 51341970
3,6-Dichloro-4-(3-chloropropyl)pyridazine
CID 183697
3,6-Dichloro-4-(4-chlorobutyl)pyridazine
CID 183698
Pyridazine, 3,6-dichloro-4-(2-iodo-1,1-dimethylethyl)-
CID 183945
Pyridazine, 3,6-dichloro-4-(1,1-dimethylpropyl)-
CID 189332
3,6-Dichloro-4-(1-fluoro-2-methylpropan-2-yl)pyridazine
CID 14349829
3,6-Dichloro-4-(2-fluorocyclopropyl)pyridazine
CID 21281894
3,6-Dichloro-4-(4,4-difluoro-1-methylcyclohexyl)pyridazine
CID 22609918

Frequently Asked Questions

What is the IUPAC name of 3,6-dichloro-4-propan-2-ylpyridazine?
The IUPAC name of 3,6-dichloro-4-propan-2-ylpyridazine (CID 14024162) is 3,6-dichloro-4-propan-2-ylpyridazine.
What is the SMILES notation for 3,6-dichloro-4-propan-2-ylpyridazine?
The canonical SMILES for 3,6-dichloro-4-propan-2-ylpyridazine is CC(C)c1cc(Cl)nnc1Cl.
What is the InChIKey of 3,6-dichloro-4-propan-2-ylpyridazine?
The InChIKey is JRZDBBCBIQEJLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8Cl2N2/c1-4(2)5-3-6(8)10-11-7(5)9/h3-4H,1-2H3.
What are the key properties of 3,6-dichloro-4-propan-2-ylpyridazine?
3,6-dichloro-4-propan-2-ylpyridazine has a molecular weight of 191.06 g/mol, XLogP of 2.91, 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-propan-2-ylpyridazine is sourced from PubChem (CID 14024162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).