3-Nitro-2-(2-phenylsulfanyl-ethylsulfanyl)pyridine

HCID 67134239
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Basic information

Standard SMILES
O=[N+]([O-])c1cccnc1SCCSc1ccccc1
InChIKey
BRLAJHMCCWNYIC-UHFFFAOYSA-N
Molecular formula
C13H12N2O2S2
Average molar mass
292.4 g/mol

Names & identifiers

Preferred name
3-Nitro-2-(2-phenylsulfanyl-ethylsulfanyl)pyridine
IUPAC
3-nitro-2-(2-phenylsulfanylethylsulfanyl)pyridine

Names & synonyms

SCHEMBL1722633BRLAJHMCCWNYIC-UHFFFAOYSA-N3-nitro-2-(2-phenylsulfanyl-ethylsulfanyl)pyridine

Database identifiers

PubChem CID
67134239

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
109 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
19

Related reactions

2 records
New reaction record

Linked notes

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