2.0 2012-05-31 14:27:05 -0600 2015-06-03 17:19:18 -0600 ECMDB20093 M2MDB000941 4-Hydroxyphenylacetaldehyde 4-hydroxyphenylacetaldehyde is a member of the chemical class known as Phenylacetaldehydes. These are compounds containing a phenylacetaldehyde moiety, which consists of a phenyl group substituted at the second position by an acetalydehyde. (4-hydroxyphenyl)acetaldehyde -dimethylamino 2-(4-Hydroxyphenyl)acetaldehyde 4-(Dimethylamino)azobenzene 4-(Dimethylamino)azobenzol 4-(Dimethylamino)phenylazobenzene 4-(N,N-Dimethylamino)azobenzene 4-(Phenylazo)-N,N-dimethylaniline 4-Dimethylamino 4-Hydroxy-Benzeneacetaldehyde Atul fast yellow R Azobenzene Benzeneazodimethylaniline Brilliant fast oil yellow Brilliant fast spirit yellow Brilliant fast yellow Brilliant oil yellow Brilliant oil yellow (van) Butter or methyl yellow Butter yellow Butyro flavine C.I. Solvent Yellow 2 Cerasine yellow GG DAB Dab (carcinogen) Dimethyl yellow Dimethyl yellow analar Dimethyl yellow N, N-dimethylaniline Dimethyl yellow N,N-dimethylaniline Dimethylaminoazobenzene Dimethylaminoazobenzol DMAB Enial Yellow 2G Fast oil yellow b Fast yellow Fat yellow Fat yellow a Fat yellow ad oo Fat yellow es Fat yellow es extra Fat yellow extra conc Fat yellow extra conc. Fat yellow R Fat Yellow R (8186) Grasal brilliant yellow Hydroxyacetophenone Hydrphenylac-CPD Iketon yellow extra Jaune de beurre Jaune de beurre (french) Methyl yellow N, N-Dimethyl-4-(phenylazo)benzamine N, N-Dimethyl-4-(phenylazo)benzenamine N, N-Dimethyl-4-aminoazobenzene N, N-Dimethyl-p-aminoazobenzene N,N-Dimethyl-4-(phenylazo)-Benzenamine N,N-Dimethyl-4-(phenylazo)benzamine N,N-Dimethyl-4-(phenylazo)benzenamine N,N-Dimethyl-4-(phenyldiazenyl)aniline N,N-Dimethyl-4-aminoazobenzene N,N-Dimethyl-4-phenylazoaniline N,N-Dimethyl-4-[(E)-phenyldiazenyl]aniline N,N-Dimethyl-p-(phenylazo)-Aniline N,N-Dimethyl-p-(phenylazo)aniline N,N-Dimethyl-p-aminoazobenzene N,N-Dimethyl-p-azoaniline Nchembio.105-comp15 NN-dimethyl-p-(phenylazo)-Aniline Oil yellow Oil Yellow 20 Oil Yellow 2G Oil yellow BB Oil yellow D Oil yellow DN Oil yellow FF Oil yellow FN Oil yellow g Oil yellow g (van) Oil Yellow G-2 Oil yellow GG Oil yellow GG (van) Oil yellow GR Oil yellow GR (van) Oil yellow N Oil yellow pel Oil yellow S Oleal Yellow 2G Organol yellow adm Orient oil yellow GG P-(Dimethylamino)-Azobenzene P-(Dimethylamino)azobenzene P-Dimethylamino-azobenzol P-Dimethylamino-azobenzol (german) P-Dimethylaminoazobenzen P-Dimethylaminoazobenzen (czech) P-Hydroxyphenylacetaldehyde P.D.a.b. Petrol yellow WT POH-Ph-CH2CHO Resinol yellow GR Resoform yellow gga Silotras Yellow T2G Solvent Yellow 2 Somalia yellow a Stear yellow JB Sudan GG Sudan yellow Sudan yellow GG Sudan yellow gga Toyo oil yellow g Tranlisant Waxoline yellow ad Waxoline yellow ads Yellow g soluble in grease Zlut maselna Zlut maselna (czech) Zlut rozpoustedlova 2 C8H8O2 136.1479 136.0524295 2-(4-hydroxyphenyl)acetaldehyde p-hydroxyphenylacetaldehyde 60-11-7 OC1=CC=C(CC=O)C=C1 InChI=1S/C8H8O2/c9-6-5-7-1-3-8(10)4-2-7/h1-4,6,10H,5H2 IPRPPFIAVHPVJH-UHFFFAOYSA-N Solid Extra-organism Periplasm logp 1.59 ALOGPS logs -1.36 ALOGPS solubility 5.93e+00 g/l ALOGPS melting_point 117 oC logp 1.15 ChemAxon pka_strongest_acidic 9.5 ChemAxon pka_strongest_basic -6 ChemAxon iupac 2-(4-hydroxyphenyl)acetaldehyde ChemAxon average_mass 136.1479 ChemAxon mono_mass 136.0524295 ChemAxon smiles OC1=CC=C(CC=O)C=C1 ChemAxon formula C8H8O2 ChemAxon inchi InChI=1S/C8H8O2/c9-6-5-7-1-3-8(10)4-2-7/h1-4,6,10H,5H2 ChemAxon inchikey IPRPPFIAVHPVJH-UHFFFAOYSA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 38.42 ChemAxon polarizability 13.87 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Tyrosine metabolism ec00350 Specdb::CMs 2866 Specdb::CMs 38652 Specdb::CMs 151168 Specdb::NmrOneD 34702 Specdb::NmrOneD 34703 Specdb::NmrOneD 34704 Specdb::NmrOneD 34705 Specdb::NmrOneD 34706 Specdb::NmrOneD 34707 Specdb::NmrOneD 34708 Specdb::NmrOneD 34709 Specdb::NmrOneD 34710 Specdb::NmrOneD 34711 Specdb::NmrOneD 34712 Specdb::NmrOneD 34713 Specdb::NmrOneD 34714 Specdb::NmrOneD 34715 Specdb::NmrOneD 34716 Specdb::NmrOneD 34717 Specdb::NmrOneD 34718 Specdb::NmrOneD 34719 Specdb::NmrOneD 34720 Specdb::NmrOneD 34721 Specdb::MsMs 7061 Specdb::MsMs 7062 Specdb::MsMs 7063 Specdb::MsMs 13733 Specdb::MsMs 13734 Specdb::MsMs 13735 Specdb::MsMs 2831983 Specdb::MsMs 2831984 Specdb::MsMs 2831985 Specdb::MsMs 2850022 Specdb::MsMs 2850023 Specdb::MsMs 2850024 HMDB03767 440113 389113 C03765 15621 HYDRPHENYLAC-CPD Keseler, I. M., Collado-Vides, J., Santos-Zavaleta, A., Peralta-Gil, M., Gama-Castro, S., Muniz-Rascado, L., Bonavides-Martinez, C., Paley, S., Krummenacker, M., Altman, T., Kaipa, P., Spaulding, A., Pacheco, J., Latendresse, M., Fulcher, C., Sarker, M., Shearer, A. G., Mackie, A., Paulsen, I., Gunsalus, R. P., Karp, P. D. (2011). "EcoCyc: a comprehensive database of Escherichia coli biology." Nucleic Acids Res 39:D583-D590. 21097882 Kanehisa, M., Goto, S., Sato, Y., Furumichi, M., Tanabe, M. (2012). "KEGG for integration and interpretation of large-scale molecular data sets." Nucleic Acids Res 40:D109-D114. 22080510 Primary amine oxidase P46883 AMO_ECOLI tynA http://ecmdb.ca/proteins/P46883.xml Outer membrane protein N P77747 OMPN_ECOLI ompN http://ecmdb.ca/proteins/P77747.xml Outer membrane pore protein E P02932 PHOE_ECOLI phoE http://ecmdb.ca/proteins/P02932.xml Outer membrane protein F P02931 OMPF_ECOLI ompF http://ecmdb.ca/proteins/P02931.xml Outer membrane protein C P06996 OMPC_ECOLI ompC http://ecmdb.ca/proteins/P06996.xml Water + Oxygen + Tyramine > 4-Hydroxyphenylacetaldehyde + Hydrogen peroxide + Ammonium Tyramine + Water + Oxygen <> 4-Hydroxyphenylacetaldehyde + Ammonia + Hydrogen peroxide R02382