1.0 2010-04-08 22:08:15 UTC 2024-11-29 22:27:57 UTC FDB008789 4-Methylphenol Present in blackcurrant buds, asparagus, cooked cured pork, black tea, fermented tea, yellow passion fruit juice, malt, peated malt, kumazasa (Sasa albo-marginata), lamb's lettuce, squid and cuttlefish. Flavouring ingredient. 4-Methylphenol is found in many foods, some of which are animal foods, cereals and cereal products, tamarind, and tarragon. 1-Hydroxy-4-methylbenzene 1-Methyl-4-hydroxybenzene 4-(Pentafluorosulfanyl)phenol 4-Cresol 4-Hydroxytoluene 4-Methyl phenol 4-Methyl-phenol FEMA 2337 P-Cresol p-Cresol, 8CI p-Cresylate p-Cresylic acid p-Hydroxytoluene P-Kresol p-Methyl phenol p-Methylhydroxybenzene P-Methylphenol p-Oxytoluene p-Toluol p-Tolyl alcohol Para-cresol Para-cresylic acid Paracresol Paramethyl phenol Phenol, 4-methyl- Taurylic acid C7H8O 108.1378 108.057514878 4-methylphenol P-cresol 106-44-5 CC1=CC=C(O)C=C1 InChI=1S/C7H8O/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H3 IWDCLRJOBJJRNH-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 1-hydroxy-2-unsubstituted benzenoids Hydrocarbon derivatives Organooxygen compounds Toluenes 1-hydroxy-2-unsubstituted benzenoid Aromatic homomonocyclic compound Hydrocarbon derivative Monocyclic benzene moiety Organic oxygen compound Organooxygen compound P-cresol Toluene a methylphenol cresol Solid logp 1.95 ALOGPS logs -0.67 ALOGPS solubility 2.31e+01 g/l ALOGPS melting_point Mp 36° logp 2.18 ChemAxon pka_strongest_acidic 10.36 ChemAxon pka_strongest_basic -5.4 ChemAxon iupac 4-methylphenol ChemAxon average_mass 108.1378 ChemAxon mono_mass 108.057514878 ChemAxon smiles CC1=CC=C(O)C=C1 ChemAxon formula C7H8O ChemAxon inchi InChI=1S/C7H8O/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H3 ChemAxon inchikey IWDCLRJOBJJRNH-UHFFFAOYSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 33.08 ChemAxon polarizability 11.93 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Metabolism and Physiological Effects of Para-cresol SMP0123214 Metabolism and Physiological Effects of Para-cresyl glucuronide SMP0123299 Metabolism and Physiological Effects of p-Cresol sulphate SMP0126850 Metabolism and Physiological Effects of 4-Hydroxyphenylacetic acid SMP0126879 Specdb::EiMs 129 Specdb::NmrTwoD 1700 Specdb::CMs 3422 Specdb::CMs 26739 Specdb::CMs 26989 Specdb::CMs 27770 Specdb::CMs 29484 Specdb::CMs 31780 Specdb::CMs 38149 Specdb::CMs 99708 Specdb::CMs 99709 Specdb::CMs 99710 Specdb::CMs 99711 Specdb::CMs 99712 Specdb::CMs 131518 Specdb::CMs 139252 Specdb::NmrOneD 1760 Specdb::NmrOneD 2089 Specdb::NmrOneD 2783 Specdb::NmrOneD 5117 Specdb::NmrOneD 5118 Specdb::MsIr 1378 Specdb::MsIr 1379 Specdb::MsIr 1380 Specdb::MsMs 1729 Specdb::MsMs 1730 Specdb::MsMs 1731 Specdb::MsMs 5493 Specdb::MsMs 5494 Specdb::MsMs 5495 Specdb::MsMs 5496 Specdb::MsMs 180147 Specdb::MsMs 180148 Specdb::MsMs 180149 Specdb::MsMs 182481 Specdb::MsMs 182482 Specdb::MsMs 182483 Specdb::MsMs 1471225 Specdb::MsMs 2740414 Specdb::MsMs 2740415 Specdb::MsMs 2740416 Specdb::MsMs 2937874 Specdb::MsMs 2937875 Specdb::MsMs 2937876 HMDB01858 17847 PCR #<Reference:0x00007f093c072cf8> #<Reference:0x00007f093c072b40> #<Reference:0x00007f093c072988> #<Reference:0x00007f093c0727d0> #<Reference:0x00007f093c072618> #<Reference:0x00007f093c072460> #<Reference:0x00007f093c0722a8> #<Reference:0x00007f093c0720f0> #<Reference:0x00007f093c071f38> #<Reference:0x00007f093c071d80> #<Reference:0x00007f093c071bc8> #<Reference:0x00007f093c071a10> #<Reference:0x00007f093c071858> Almond Type 1 specific Prunus dulcis 3755 Anatidae Type 1 specific Anatidae 8830 Anise Type 1 specific Pimpinella anisum 271192 Arabica coffee Type 1 specific Coffea arabica 13443 Asparagus Type 1 specific Asparagus officinalis 4686 Beefalo Type 1 specific Bos taurus X Bison bison 297284 Bilberry Type 1 specific Vaccinium myrtillus 180763 0.00005 0.0001 0.0 mg/100 g Bison Type 1 specific Bison bison 9901 Black tea Type 1 Breakfast cereal Type 2 specific Buffalo Type 1 specific Bubalus bubalis 89462 Cattle (Beef, Veal) Type 1 specific Bos taurus 9913 Cereals and cereal products Unknown generic Cherry tomato Type 1 specific Solanum lycopersicum var. cerasiforme 195583 Chicken Type 1 specific Gallus gallus 9031 Chinese cinnamon Type 1 specific Cinnamomum aromaticum 119260 Columbidae (Dove, Pigeon) Type 1 specific Columbidae 8930 Crustaceans Unknown generic 6657 Deer Type 1 specific Cervidae 9850 Domestic goat Type 1 specific Capra aegagrus hircus 9925 Domestic pig Type 1 specific Sus scrofa domestica 9825 Eggplant Type 1 specific Solanum melongena 4111 Elk Type 1 specific Cervus canadensis 1574408 Emu Type 1 specific Dromaius novaehollandiae 8790 European rabbit Type 1 specific Oryctolagus 9984 Fruits Unknown generic Garden tomato Type 1 specific Solanum lycopersicum 4081 Garden tomato (var.) Type 1 specific Solanum lycopersicum var. lycopersicum 397755 Green bell pepper Type 1 specific Capsicum annuum 4072 Green tea Type 1 Green vegetables Unknown generic Greylag goose Type 1 specific Anser anser 8843 Guinea hen Type 1 specific Numida meleagris 8996 Herbal tea Type 1 Highbush blueberry Type 1 specific Vaccinium corymbosum 69266 Horse Type 1 specific Equus caballus 9796 Mallard duck Type 1 specific Anas platyrhynchos 8839 Milk (Cow) Type 2 specific 12.206667 13.87 9.36 uM Mountain hare Type 1 specific Lepus timidus 62621 Mulberry Type 1 specific Morus 3497 Mule deer Type 1 specific Odocoileus 9871 Orange bell pepper Type 1 specific Capsicum annuum 4072 Ostrich Type 1 specific Struthio camelus 8801 Pepper Type 1 specific Capsicum annuum 4072 Peppermint Type 1 specific Mentha X piperita 34256 0.0011 0.0011 0.0011 mg/100 g Pheasant Type 1 specific Phasianus colchicus 9054 Quail Type 1 specific Phasianidae 9005 Rabbit Type 1 specific Leporidae 9979 Red bell pepper Type 1 specific Capsicum annuum 4072 Red raspberry Type 1 specific Rubus idaeus 32247 Red tea Type 1 Rock ptarmigan Type 1 specific Lagopus muta 64668 Sheep (Mutton, Lamb) Type 1 specific Ovis aries 9940 Sour cherry Type 1 specific Prunus cerasus 140311 Squab Type 1 specific Columba 8931 Tamarind Type 1 specific Tamarindus indica 58860 Tarragon Type 1 specific Artemisia dracunculus 72341 Tea Type 1 specific Camellia sinensis 4442 Turkey Type 1 specific Meleagris gallopavo 9103 Velvet duck Type 1 specific Melanitta fusca 371864 White mustard Type 1 specific Sinapis alba 3728 Wild boar Type 1 specific Sus scrofa 9823 Yellow bell pepper Type 1 specific Capsicum annuum 4072 animal medicinal medicine mimosa narcissus phenol phenolic smoke Allelochemic 41 Anti septic 603 A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans. Anti-mutagenic 451 Cancer preventive 754 A substance that inhibits or prevents the proliferation of neoplasms. Hemolytic 973 Irritant 1055 Name 936 A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell. Parasiticide 1198 Pesticide 1210 Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. Rodenticide 1300 A substance used to destroy rodent pests.