1.0 2010-04-08 22:09:07 UTC 2018-05-28 23:27:57 UTC FDB010421 2,4,6-Trimethylphenol It is used as a food additive . 1-Hydroxy-2,4,6-trimethylbenzene 1,3,5-Trimethylphenol 2-Hydroxy-1,3,5-trimethyl-benzene 2-Hydroxymesitylene 2,4, 6-Trimethylphenol 2,4,6-Trimethyl-phenol 2,4,6-Trimethylofenol 2,4,6-Trimetylofenol Benzene, 2-hydroxy-1,3,5-trimethyl- BENZENE,1-HYDROXY,2,4,6-TRIMETHYL Mesitol Mesityl alcohol Phenol, 2,4,6-trimethyl- C9H12O 136.191 136.088815006 2,4,6-trimethylphenol 2,4,6-trimethylphenol 527-60-6 CC1=CC(C)=C(O)C(C)=C1 InChI=1S/C9H12O/c1-6-4-7(2)9(10)8(3)5-6/h4-5,10H,1-3H3 BPRYUXCVCCNUFE-UHFFFAOYSA-N belongs to the class of organic compounds known as para cresols. Para cresols are compounds containing a para cresol moiety, which consists of a benzene ring bearing one hydroxyl group at ring positions 1 and 4. Para cresols Organic compounds Benzenoids Phenols Cresols Aromatic homomonocyclic compounds Benzene and substituted derivatives Hydrocarbon derivatives Organooxygen compounds Ortho cresols Aromatic homomonocyclic compound Hydrocarbon derivative Monocyclic benzene moiety O-cresol Organic oxygen compound Organooxygen compound P-cresol logp 2.72 ALOGPS logs -1.84 ALOGPS solubility 1.97e+00 g/l ALOGPS melting_point 73 oC logp 3.21 ChemAxon pka_strongest_acidic 11.07 ChemAxon pka_strongest_basic -5.4 ChemAxon iupac 2,4,6-trimethylphenol ChemAxon average_mass 136.191 ChemAxon mono_mass 136.088815006 ChemAxon smiles CC1=CC(C)=C(O)C(C)=C1 ChemAxon formula C9H12O ChemAxon inchi InChI=1S/C9H12O/c1-6-4-7(2)9(10)8(3)5-6/h4-5,10H,1-3H3 ChemAxon inchikey BPRYUXCVCCNUFE-UHFFFAOYSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 43.16 ChemAxon polarizability 16.05 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 19180 Specdb::CMs 27691 Specdb::CMs 42845 Specdb::CMs 101157 Specdb::CMs 131187 Specdb::CMs 138921 Specdb::MsIr 5524 Specdb::MsIr 5525 Specdb::MsIr 5526 Specdb::MsMs 79983 Specdb::MsMs 79984 Specdb::MsMs 79985 Specdb::MsMs 140700 Specdb::MsMs 140701 Specdb::MsMs 140702 Specdb::MsMs 2791157 Specdb::MsMs 2791158 Specdb::MsMs 2791159 Specdb::MsMs 2914406 Specdb::MsMs 2914407 Specdb::MsMs 2914408 Specdb::NmrOneD 113838 Specdb::NmrOneD 113839 Specdb::NmrOneD 113840 Specdb::NmrOneD 113841 Specdb::NmrOneD 113842 Specdb::NmrOneD 113843 Specdb::NmrOneD 113844 Specdb::NmrOneD 113845 Specdb::NmrOneD 113846 Specdb::NmrOneD 113847 Specdb::NmrOneD 113848 Specdb::NmrOneD 113849 Specdb::NmrOneD 113850 Specdb::NmrOneD 113851 Specdb::NmrOneD 113852 Specdb::NmrOneD 113853 Specdb::NmrOneD 113854 Specdb::NmrOneD 113855 Specdb::NmrOneD 113856 Specdb::NmrOneD 113857 HMDB32544 #<Reference:0x000055ce32a016c0> mild phenolic