1.02010-04-08 22:04:45 UTC2020-02-24 19:10:16 UTCFDB0009112-ThiophenecarboxaldehydeFlavour ingredientα-formylthiopheneα-thiophenecarboxaldehyde2-Carboxaldehyde-thiophene2-Formylthiophene2-Thienal2-Thienaldehyde2-Thienylaldehyde2-Thienylcarboxaldehyde2-Thiophenaldehyde2-thiophencarboxaldehyde2-thiophene carboxyaldehyde2-Thiophenealdehyde2-Thiophenecarbaldehyde2-thiophenic aldehydea-Thenaldehydealpha -Formylthiophenealpha -ThiophenecarboxaldehydeAlpha-formylthiopheneAlpha-thiophenecarboxaldehydeThenaldehydethiophen-2-carboxaldehydeThiophene-2-aldehydeThiophene-2-carbaldehydeThiophene-2-carboxaldehydeThiophenecarboxaldehydeC5H4OS112.15111.99828544thiophene-2-carbaldehydethiophene-2-carboxaldehyde98-03-3O=CC1=CC=CS1InChI=1S/C5H4OS/c6-4-5-2-1-3-7-5/h1-4HCNUDBTRUORMMPA-UHFFFAOYSA-N belongs to the class of organic compounds known as aryl-aldehydes. Aryl-aldehydes are compounds containing an aldehyde group directly attached to an aromatic ring.Aryl-aldehydesOrganic compoundsOrganic oxygen compoundsOrganooxygen compoundsCarbonyl compoundsAromatic heteromonocyclic compoundsHeteroaromatic compoundsHydrocarbon derivativesOrganic oxidesThiophenesAromatic heteromonocyclic compoundAryl-aldehydeHeteroaromatic compoundHydrocarbon derivativeOrganic oxideOrganoheterocyclic compoundThiophenealdehydethiopheneslogp1.00logs-1.93solubility1.31e+00 g/llogp1.6pka_strongest_basic-7.5iupacthiophene-2-carbaldehydeaverage_mass112.15mono_mass111.99828544smilesO=CC1=CC=CS1formulaC5H4OSinchiInChI=1S/C5H4OS/c6-4-5-2-1-3-7-5/h1-4HinchikeyCNUDBTRUORMMPA-UHFFFAOYSA-Npolar_surface_area17.07refractivity29.53polarizability10.67rotatable_bond_count1acceptor_count1donor_count0physiological_charge0formal_charge0Specdb::CMs2467Specdb::CMs29444Specdb::CMs100427Specdb::CMs146308Specdb::MsMs81138Specdb::MsMs81139Specdb::MsMs81140Specdb::MsMs142176Specdb::MsMs142177Specdb::MsMs142178Specdb::MsMs2465793Specdb::MsMs2465794Specdb::MsMs2465795Specdb::MsMs2497250Specdb::MsMs2497251Specdb::MsMs2497252Specdb::MsIr3625Specdb::MsIr3626Specdb::NmrOneD159130Specdb::NmrOneD159131Specdb::NmrOneD159132Specdb::NmrOneD159133Specdb::NmrOneD159134Specdb::NmrOneD159135Specdb::NmrOneD159136Specdb::NmrOneD159137Specdb::NmrOneD159138Specdb::NmrOneD159139Specdb::NmrOneD159140Specdb::NmrOneD159141Specdb::NmrOneD159142Specdb::NmrOneD159143Specdb::NmrOneD159144Specdb::NmrOneD159145Specdb::NmrOneD159146Specdb::NmrOneD159147Specdb::NmrOneD159148Specdb::NmrOneD159149HMDB29717#<Reference:0x000055567408c0a8>AsparagusType 1specificAsparagus officinalis4686sulfursulfurous