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2-Chloro-4-(2,3-dichlorophenylthio)pyridine

HCID 86634733
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Clc1cc(Sc2cccc(Cl)c2Cl)ccn1
InChIKey
ANDAUMGOLYIIMM-UHFFFAOYSA-N
Molecular formula
C11H6Cl3NS
Average molar mass
290.6 g/mol

Names & identifiers

Preferred name
2-Chloro-4-(2,3-dichlorophenylthio)pyridine
IUPAC
2-chloro-4-(2,3-dichlorophenyl)sulfanylpyridine

Names & synonyms

2-chloro-4-(2,3-dichlorophenylthio)pyridineSCHEMBL191746ANDAUMGOLYIIMM-UHFFFAOYSA-N

Database identifiers

PubChem CID
86634733

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
38.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
229

Related reactions

3 records
New reaction record
HRID 910985 reaction equation
HRID 910985As productuspto-grants-2011_09
HRID 910986 reaction equation
HRID 910986As reactantuspto-grants-2011_09
HRID 1133652 reaction equation
HRID 1133652As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes