4-(3-Methyl-2-pyridyl)butylammonium sulphate

HCID 70422992
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Basic information

Standard SMILES
Cc1cccnc1CCCC[NH3+].Cc1cccnc1CCCC[NH3+].O=S(=O)([O-])[O-]
InChIKey
DPSSZYVUMFRKPL-UHFFFAOYSA-N
Molecular formula
C20H34N4O4S
Average molar mass
426.6 g/mol
Monoisotopic mass
426.23007675

Names & identifiers

Preferred name
4-(3-Methyl-2-pyridyl)butylammonium sulphate
IUPAC
bis(4-(3-methyl-2-pyridinyl)butylazanium);sulfate

Names & synonyms

DPSSZYVUMFRKPL-UHFFFAOYSA-N4-(3-methyl-2-pyridyl)butylammonium sulphate

Database identifiers

PubChem CID
70422992

Properties

Computed structural properties

Topological polar surface area
170 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
29

Related reactions

1 records
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Compound notes

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