1.02010-04-08 22:09:40 UTC2019-11-26 03:05:01 UTCFDB0115014-Hexen-1-olFlavouring ingredient. 4-Hexen-1-ol is found in black elderberry.FEMA 3430C6H12O100.1589100.088815006(4Z)-hex-4-en-1-ol(4Z)-hex-4-en-1-ol6126-50-7C\C=C/CCCOInChI=1S/C6H12O/c1-2-3-4-5-6-7/h2-3,7H,4-6H2,1H3/b3-2-VTIODUHBZHNXFP-IHWYPQMZSA-N belongs to the class of organic compounds known as fatty alcohols. These are aliphatic alcohols consisting of a chain of a least six carbon atoms.Fatty alcoholsOrganic compoundsLipids and lipid-like moleculesFatty AcylsFatty alcoholsAliphatic acyclic compoundsHydrocarbon derivativesPrimary alcoholsAlcoholAliphatic acyclic compoundFatty alcoholHydrocarbon derivativeOrganic oxygen compoundOrganooxygen compoundPrimary alcohollogp1.74logs-0.80solubility1.59e+01 g/llogp1.33pka_strongest_acidic16.96pka_strongest_basic-1.9iupac(4Z)-hex-4-en-1-olaverage_mass100.1589mono_mass100.088815006smilesC\C=C/CCCOformulaC6H12OinchiInChI=1S/C6H12O/c1-2-3-4-5-6-7/h2-3,7H,4-6H2,1H3/b3-2-inchikeyVTIODUHBZHNXFP-IHWYPQMZSA-Npolar_surface_area20.23refractivity32.45polarizability12.44rotatable_bond_count3acceptor_count1donor_count1physiological_charge0formal_charge0Specdb::CMs17330Specdb::CMs42506Specdb::CMs165395Specdb::MsIr4529Specdb::MsIr4530Specdb::MsIr4531Specdb::NmrOneD164269Specdb::NmrOneD164270Specdb::NmrOneD164271Specdb::NmrOneD164272Specdb::NmrOneD164273Specdb::NmrOneD164274Specdb::NmrOneD164275Specdb::NmrOneD164276Specdb::NmrOneD164277Specdb::NmrOneD164278Specdb::NmrOneD164279Specdb::NmrOneD164280Specdb::NmrOneD164281Specdb::NmrOneD164282Specdb::NmrOneD164283Specdb::NmrOneD164284Specdb::NmrOneD164285Specdb::NmrOneD164286Specdb::NmrOneD164287Specdb::NmrOneD164288Specdb::MsMs92424Specdb::MsMs92425Specdb::MsMs92426Specdb::MsMs156033Specdb::MsMs156034Specdb::MsMs156035Specdb::MsMs2801383Specdb::MsMs2801384Specdb::MsMs2801385Specdb::MsMs2877710Specdb::MsMs2877711Specdb::MsMs2877712Black elderberryType 1specificSambucus nigra4202greenpungentvegetable