6-chloro-3-ethenyl-4-methoxypyridazine

C7H7ClN2O — CID 164537221

IUPAC6-chloro-3-ethenyl-4-methoxypyridazine
SMILESC=Cc1nnc(Cl)cc1OC
InChIInChI=1S/C7H7ClN2O/c1-3-5-6(11-2)4-7(8)10-9-5/h3-4H,1H2,2H3
InChIKeyWLBVTDXIANEJRI-UHFFFAOYSA-N
MW170.60 g/mol
LogP1.78
Rot. Bonds2

About 6-chloro-3-ethenyl-4-methoxypyridazine

6-chloro-3-ethenyl-4-methoxypyridazine (PubChem CID 164537221) has the molecular formula C7H7ClN2O and a molecular weight of 170.60 g/mol. Its IUPAC name is 6-chloro-3-ethenyl-4-methoxypyridazine.

Molecular Properties

Compound Name6-chloro-3-ethenyl-4-methoxypyridazine
PubChem CID164537221
Molecular FormulaC7H7ClN2O
Molecular Weight170.60 g/mol
Exact Mass170.02
IUPAC Name6-chloro-3-ethenyl-4-methoxypyridazine
SMILESC=Cc1nnc(Cl)cc1OC
InChIInChI=1S/C7H7ClN2O/c1-3-5-6(11-2)4-7(8)10-9-5/h3-4H,1H2,2H3
InChIKeyWLBVTDXIANEJRI-UHFFFAOYSA-N
XLogP1.78
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.60
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-ethenyl-4-methoxypyridazine?
The IUPAC name of 6-chloro-3-ethenyl-4-methoxypyridazine (CID 164537221) is 6-chloro-3-ethenyl-4-methoxypyridazine.
What is the SMILES notation for 6-chloro-3-ethenyl-4-methoxypyridazine?
The canonical SMILES for 6-chloro-3-ethenyl-4-methoxypyridazine is C=Cc1nnc(Cl)cc1OC.
What is the InChIKey of 6-chloro-3-ethenyl-4-methoxypyridazine?
The InChIKey is WLBVTDXIANEJRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN2O/c1-3-5-6(11-2)4-7(8)10-9-5/h3-4H,1H2,2H3.
What are the key properties of 6-chloro-3-ethenyl-4-methoxypyridazine?
6-chloro-3-ethenyl-4-methoxypyridazine has a molecular weight of 170.60 g/mol, XLogP of 1.78, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-ethenyl-4-methoxypyridazine is sourced from PubChem (CID 164537221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).