3,4-dibromopyridazine

C4H2Br2N2 — CID 21281878

IUPAC3,4-dibromopyridazine
SMILESBrc1ccnnc1Br
InChIInChI=1S/C4H2Br2N2/c5-3-1-2-7-8-4(3)6/h1-2H
InChIKeyAQZJVJXVTVCMCZ-UHFFFAOYSA-N
MW237.88 g/mol
LogP2.00
Rot. Bonds

About 3,4-dibromopyridazine

3,4-dibromopyridazine (PubChem CID 21281878) has the molecular formula C4H2Br2N2 and a molecular weight of 237.88 g/mol. Its IUPAC name is 3,4-dibromopyridazine.

Molecular Properties

Compound Name3,4-dibromopyridazine
PubChem CID21281878
Molecular FormulaC4H2Br2N2
Molecular Weight237.88 g/mol
Exact Mass235.86
IUPAC Name3,4-dibromopyridazine
SMILESBrc1ccnnc1Br
InChIInChI=1S/C4H2Br2N2/c5-3-1-2-7-8-4(3)6/h1-2H
InChIKeyAQZJVJXVTVCMCZ-UHFFFAOYSA-N
XLogP2.00
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.88
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dibromopyridazine?
The IUPAC name of 3,4-dibromopyridazine (CID 21281878) is 3,4-dibromopyridazine.
What is the SMILES notation for 3,4-dibromopyridazine?
The canonical SMILES for 3,4-dibromopyridazine is Brc1ccnnc1Br.
What is the InChIKey of 3,4-dibromopyridazine?
The InChIKey is AQZJVJXVTVCMCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H2Br2N2/c5-3-1-2-7-8-4(3)6/h1-2H.
What are the key properties of 3,4-dibromopyridazine?
3,4-dibromopyridazine has a molecular weight of 237.88 g/mol, XLogP of 2.00, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dibromopyridazine is sourced from PubChem (CID 21281878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).