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2-Hexylbenzothiazole

PropertiesImage
MNX_IDMNXM116760 Image of MNXM116760
referencechebi:174110
formulaC13H17NS
global charge0
mol weight219.353
InChIKeyXETMGEVGSLTKRW-UHFFFAOYSA-N
InChIInChI=1S/C13H17NS/c1-2-3-4-5-10-13-14-11-8-6-7-9-12(11)15-13/h6-9H,2-5,10H2,1H3
SMILESCCCCCCC1=NC2=C(C=CC=C2)S1
MNX internals
InChI (mnx)InChI=1/C13H17NS/c1-2-3-4-5-10-13-14-11-8-6-7-9-12(11)15-13/h6-9H,2-5,10H2,1H3 Image of MNXM116760
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:10][C:13]1=[N:14][C:11]2=[CH:8][CH:6]=[CH:7][CH:9]=[C:12]2[S:15]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

hmdb:HMDB0040032
CHEBI:174110
chebi:174110
XETMGEVGSLTKRW-UHFFFAOYSA-N
2-Hexylbenzothiazole
2-hexyl-1,3-benzothiazole

hmdb:HMDB40032
secondary/obsolete/fantasy identifier