Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID001858

Phytochemical name: Dipropyl disulfide

Synonymous chemical names:
dipropyl disulfide, propyl disulfide, di, dipropyl disulphide, dipropyl-disulfide, dipropyl disulfide, dipropyl disulfid

External chemical identifiers:
CID:CID_12377, ChEBI:CHEBI:45758, ZINC:ZINC000001531084, FDASRS:I7K169J70F, SureChEMBL:SCHEMBL113363, MolPort-003-926-595

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Chemical structure information

SMILES:
CCCSSCCC

InChI:
InChI=1S/C6H14S2/c1-3-5-7-8-6-4-2/h3-6H2,1-2H3

InChIKey:
ALVPFGSHPUPROW-UHFFFAOYSA-N

DeepSMILES:
CCCSSCCC

Functional groups:
CSSC

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organosulfur compounds

ClassyFire Class: Organic disulfides

ClassyFire Subclass: Dialkyldisulfides

NP-Likeness score: 0.276

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Chemical structure download