1.0 2010-04-08 22:12:01 UTC 2015-07-20 23:21:38 UTC FDB015740 Azorhodine 2G Colourant additive for food 5-(Acetylamino)-4-hydroxy-3-(phenylazo)-2,7-naphthalenedisulfonic acid, 9CI Brilliant acid red G C.I. 18050 C.I. Acid red 1 C.I. Food red 10 E128 Fast crimson GR Naphthazine rose 2G Red 2G Solar fast red 3G Vopsider red ASTR G C18H15N3O8S2 465.457 465.030055851 5-acetamido-4-hydroxy-3-[(E)-2-phenyldiazen-1-yl]naphthalene-2,7-disulfonic acid 5-acetamido-4-hydroxy-3-[(E)-2-phenyldiazen-1-yl]naphthalene-2,7-disulfonic acid CC(=O)NC1=CC(=CC2=C1C(O)=C(\N=N\C1=CC=CC=C1)C(=C2)S(O)(=O)=O)S(O)(=O)=O InChI=1S/C18H15N3O8S2/c1-10(22)19-14-9-13(30(24,25)26)7-11-8-15(31(27,28)29)17(18(23)16(11)14)21-20-12-5-3-2-4-6-12/h2-9,23H,1H3,(H,19,22)(H,24,25,26)(H,27,28,29)/b21-20+ RSNSKUBBVCGSND-QZQOTICOSA-N belongs to the class of organic compounds known as 2-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring. 2-naphthalene sulfonates Organic compounds Benzenoids Naphthalenes Naphthalene sulfonic acids and derivatives Aromatic homopolycyclic compounds 1-hydroxy-4-unsubstituted benzenoids 1-sulfo,2-unsubstituted aromatic compounds 2-naphthalene sulfonic acids and derivatives Acetamides Azo compounds Benzene and substituted derivatives Carbonyl compounds Hydrocarbon derivatives N-acetylarylamines Naphthols and derivatives Organic oxides Organopnictogen compounds Organosulfonic acids Propargyl-type 1,3-dipolar organic compounds Secondary carboxylic acid amides Sulfonyls 1-hydroxy-4-unsubstituted benzenoid 1-naphthol 1-sulfo,2-unsubstituted aromatic compound 2-naphthalene sulfonate 2-naphthalene sulfonic acid or derivatives Acetamide Aromatic homopolycyclic compound Arylsulfonic acid or derivatives Azo compound Carbonyl group Carboxamide group Carboxylic acid derivative Hydrocarbon derivative Monocyclic benzene moiety N-acetylarylamine N-arylamide Organic 1,3-dipolar compound Organic nitrogen compound Organic oxide Organic oxygen compound Organic sulfonic acid or derivatives Organonitrogen compound Organooxygen compound Organopnictogen compound Organosulfonic acid Organosulfonic acid or derivatives Organosulfur compound Propargyl-type 1,3-dipolar organic compound Secondary carboxylic acid amide Sulfonyl logp -0.46 ALOGPS logs -4.06 ALOGPS solubility 4.08e-02 g/l ALOGPS logp -1.4 ChemAxon pka_strongest_acidic -2.9 ChemAxon pka_strongest_basic -0.43 ChemAxon iupac 5-acetamido-4-hydroxy-3-[(E)-2-phenyldiazen-1-yl]naphthalene-2,7-disulfonic acid ChemAxon average_mass 465.457 ChemAxon mono_mass 465.030055851 ChemAxon smiles CC(=O)NC1=CC(=CC2=C1C(O)=C(\N=N\C1=CC=CC=C1)C(=C2)S(O)(=O)=O)S(O)(=O)=O ChemAxon formula C18H15N3O8S2 ChemAxon inchi InChI=1S/C18H15N3O8S2/c1-10(22)19-14-9-13(30(24,25)26)7-11-8-15(31(27,28)29)17(18(23)16(11)14)21-20-12-5-3-2-4-6-12/h2-9,23H,1H3,(H,19,22)(H,24,25,26)(H,27,28,29)/b21-20+ ChemAxon inchikey RSNSKUBBVCGSND-QZQOTICOSA-N ChemAxon polar_surface_area 182.79 ChemAxon refractivity 114.92 ChemAxon polarizability 44.09 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 10 ChemAxon donor_count 4 ChemAxon physiological_charge -2 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 20923 Specdb::CMs 45040 Specdb::CMs 165302 Specdb::MsMs 96282 Specdb::MsMs 96283 Specdb::MsMs 96284 Specdb::MsMs 160731 Specdb::MsMs 160732 Specdb::MsMs 160733 Specdb::MsMs 2765309 Specdb::MsMs 2765310 Specdb::MsMs 2765311 Specdb::MsMs 2944396 Specdb::MsMs 2944397 Specdb::MsMs 2944398 Specdb::NmrOneD 136950 Specdb::NmrOneD 136951 Specdb::NmrOneD 136952 Specdb::NmrOneD 136953 Specdb::NmrOneD 136954 Specdb::NmrOneD 136955 Specdb::NmrOneD 136956 Specdb::NmrOneD 136957 Specdb::NmrOneD 136958 Specdb::NmrOneD 136959 Specdb::NmrOneD 136960 Specdb::NmrOneD 136961 Specdb::NmrOneD 136962 Specdb::NmrOneD 136963 Specdb::NmrOneD 136964 Specdb::NmrOneD 136965 Specdb::NmrOneD 136966 Specdb::NmrOneD 136967 Specdb::NmrOneD 136968 Specdb::NmrOneD 136969 HMDB36794 #<Reference:0x000055ce31d5b470>