6-bromo-3,4-dimethylpyridazine

C6H7BrN2 — CID 83697278

IUPAC6-bromo-3,4-dimethylpyridazine
SMILESCc1cc(Br)nnc1C
InChIInChI=1S/C6H7BrN2/c1-4-3-6(7)9-8-5(4)2/h3H,1-2H3
InChIKeyCCSQHDUFFAISAN-UHFFFAOYSA-N
MW187.04 g/mol
LogP1.86
Rot. Bonds

About 6-bromo-3,4-dimethylpyridazine

6-bromo-3,4-dimethylpyridazine (PubChem CID 83697278) has the molecular formula C6H7BrN2 and a molecular weight of 187.04 g/mol. Its IUPAC name is 6-bromo-3,4-dimethylpyridazine.

Molecular Properties

Compound Name6-bromo-3,4-dimethylpyridazine
PubChem CID83697278
Molecular FormulaC6H7BrN2
Molecular Weight187.04 g/mol
Exact Mass185.98
IUPAC Name6-bromo-3,4-dimethylpyridazine
SMILESCc1cc(Br)nnc1C
InChIInChI=1S/C6H7BrN2/c1-4-3-6(7)9-8-5(4)2/h3H,1-2H3
InChIKeyCCSQHDUFFAISAN-UHFFFAOYSA-N
XLogP1.86
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.04
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-3,4-dimethylpyridazine?
The IUPAC name of 6-bromo-3,4-dimethylpyridazine (CID 83697278) is 6-bromo-3,4-dimethylpyridazine.
What is the SMILES notation for 6-bromo-3,4-dimethylpyridazine?
The canonical SMILES for 6-bromo-3,4-dimethylpyridazine is Cc1cc(Br)nnc1C.
What is the InChIKey of 6-bromo-3,4-dimethylpyridazine?
The InChIKey is CCSQHDUFFAISAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7BrN2/c1-4-3-6(7)9-8-5(4)2/h3H,1-2H3.
What are the key properties of 6-bromo-3,4-dimethylpyridazine?
6-bromo-3,4-dimethylpyridazine has a molecular weight of 187.04 g/mol, XLogP of 1.86, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3,4-dimethylpyridazine is sourced from PubChem (CID 83697278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).