1.0 2010-04-08 22:04:48 UTC 2019-11-26 02:55:49 UTC FDB001032 2,5-Diisopropyl-4-methylphenol Constituent of the essential oil of Coridothymus capitatus (Spanish oregano). 2,5-Diisopropyl-4-methylphenol is found in herbs and spices. 2,5-Diisopropyl-p-cresol, 8CI 4-Methyl-2,5-bis(1-methylethyl)phenol, 9CI 4-methyl-2,5-diisopropylphenol C13H20O 192.2973 192.151415262 4-methyl-2,5-bis(propan-2-yl)phenol 2,5-diisopropyl-4-methylphenol 15269-16-6 CC(C)C1=CC(O)=C(C=C1C)C(C)C InChI=1S/C13H20O/c1-8(2)11-7-13(14)12(9(3)4)6-10(11)5/h6-9,14H,1-5H3 UJBZHJNVIHOWFA-UHFFFAOYSA-N belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring. Aromatic monoterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Monoterpenoids Aromatic homomonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids Cumenes Hydrocarbon derivatives Monocyclic monoterpenoids Organooxygen compounds Para cresols Phenylpropanes Toluenes 1-hydroxy-2-unsubstituted benzenoid Aromatic homomonocyclic compound Aromatic monoterpenoid Benzenoid Cumene Hydrocarbon derivative Monocyclic benzene moiety Monocyclic monoterpenoid Organic oxygen compound Organooxygen compound P-cresol P-cymene Phenol Phenylpropane Toluene logp 4.17 ALOGPS logs -3.14 ALOGPS solubility 1.40e-01 g/l ALOGPS melting_point Mp 52.7° (51-52°) logp 4.67 ChemAxon pka_strongest_acidic 10.89 ChemAxon pka_strongest_basic -5.2 ChemAxon iupac 4-methyl-2,5-bis(propan-2-yl)phenol ChemAxon average_mass 192.2973 ChemAxon mono_mass 192.151415262 ChemAxon smiles CC(C)C1=CC(O)=C(C=C1C)C(C)C ChemAxon formula C13H20O ChemAxon inchi InChI=1S/C13H20O/c1-8(2)11-7-13(14)12(9(3)4)6-10(11)5/h6-9,14H,1-5H3 ChemAxon inchikey UJBZHJNVIHOWFA-UHFFFAOYSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 61.46 ChemAxon polarizability 23.73 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 17501 Specdb::CMs 41571 Specdb::CMs 146394 Specdb::MsIr 3719 Specdb::MsIr 3720 Specdb::MsIr 3721 Specdb::MsMs 104442 Specdb::MsMs 104443 Specdb::MsMs 104444 Specdb::MsMs 170727 Specdb::MsMs 170728 Specdb::MsMs 170729 Specdb::MsMs 2284918 Specdb::MsMs 2284919 Specdb::MsMs 2284920 Specdb::MsMs 3080523 Specdb::MsMs 3080524 Specdb::MsMs 3080525 HMDB29821 #<Reference:0x000055ce32784d48> Herbs and Spices Unknown generic