1.0 2010-04-08 22:04:42 UTC 2020-02-24 19:10:13 UTC FDB000761 Cyclohexane Diluent in colour additive mixtures for food use. Cyclohexane is found in kohlrabi. Benzene, hexahydro- Cyclohexan hexahydro-Benzene Hexahydrobenzene Hexamethylene Hexanaphthene C6H12 84.1595 84.093900384 cyclohexane cyclohexane 110-82-7 C1CCCCC1 InChI=1S/C6H12/c1-2-4-6-5-3-1/h1-6H2 XDTMQSROBMDMFD-UHFFFAOYSA-N belongs to the class of organic compounds known as cycloalkanes. These are saturated monocyclic hydrocarbons (with or without side chains). Cycloalkanes Organic compounds Hydrocarbons Saturated hydrocarbons Cycloalkanes Aliphatic homomonocyclic compounds Aliphatic homomonocyclic compound Cycloalkane a carbohydrate cycloalkane Liquid logp 3.46 ALOGPS logs -3.33 ALOGPS solubility 3.93e-02 g/l ALOGPS melting_point Mp 6.5° logp 2.67 ChemAxon iupac cyclohexane ChemAxon average_mass 84.1595 ChemAxon mono_mass 84.093900384 ChemAxon smiles C1CCCCC1 ChemAxon formula C6H12 ChemAxon inchi InChI=1S/C6H12/c1-2-4-6-5-3-1/h1-6H2 ChemAxon inchikey XDTMQSROBMDMFD-UHFFFAOYSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 27.61 ChemAxon polarizability 11.07 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::EiMs 143 Specdb::NmrOneD 2145 Specdb::NmrOneD 3452 Specdb::CMs 13002 Specdb::CMs 27067 Specdb::CMs 27161 Specdb::CMs 27239 Specdb::CMs 28500 Specdb::CMs 29971 Specdb::CMs 100346 Specdb::CMs 100347 Specdb::CMs 100348 Specdb::CMs 100349 Specdb::CMs 100350 Specdb::CMs 130925 Specdb::CMs 138659 Specdb::MsMs 7259 Specdb::MsMs 7260 Specdb::MsMs 7261 Specdb::MsMs 13931 Specdb::MsMs 13932 Specdb::MsMs 13933 Specdb::MsMs 2291694 Specdb::MsMs 2291695 Specdb::MsMs 2291696 Specdb::MsMs 2643936 Specdb::MsMs 2643937 Specdb::MsMs 2643938 HMDB29597 29005 CHX #<Reference:0x000055ce322dc7f0> #<Reference:0x000055ce322dc638> #<Reference:0x000055ce322dc480> #<Reference:0x000055ce322dc2c8> Apple Type 1 specific Malus pumila 283210 Celeriac Type 1 specific Apium graveolens var. rapaceum 278110 Celery stalks Type 1 specific Apium graveolens var. dulce 117781 Kohlrabi Type 1 specific Brassica oleracea var. gongylodes 109379 Milk (Cow) Type 2 specific