1.0 2016-05-19 01:52:58 UTC 2026-04-17 19:37:13 UTC ALGINATE, CALCIUM SmallMolecule ALGINATE, CALCIUM belongs to the substituted pyrroles, a subclass of pyrroles within the organic compounds. With an average molecular weight of 1,155 g/mol, ALGINATE, CALCIUM is a heavy molecule. It is characterized by the formula C66H68CaF2N4O10 and is classified as an organoheterocyclic compound. In industrial applications, this compound serves a wide variety of roles, functioning as a thickening agent, viscosity modifier, and stabilizing agent. It is further utilized as an emulsifier, surfactant, deodorizer, and as a flavouring and nutrient. Additionally, it is used as a processing aid not otherwise specified. ALGINATE, CALCIUM is found in or released from 22 recorded sources across multiple sectors. Within building and construction, it is associated with ceilings, fencing, floors, ladders, and roofs, among four other sources. In the category of household cleaning and consumer products, it is found in pipe accessories, soap dispensers, tobacco pipes, tobacco product cases, and tobacco product moisture control. Its use in food, food processing, and cookware includes brew kettles, the preparation of wort, the preparation of vinegar, and molasses and treatment of molasses. In electrical and electronic equipment, it is found in antennas, amplifiers, and electric hearing aids. Within healthcare, pharmaceuticals, and veterinary products, it is used in vitamin k and other hemostatics. The recorded route of exposure for this compound is topical. 1,2-Cyclohexanedicarboxylic acid, calcium salt (1:1), (1R,2S)-rel- Alkenes, C15-18 .alpha.-, reaction products with sulfurized dodecylphenol calcium salt, sulfurized Atorvastatin calcium Benzenesulfonic acid, 4-chloro-2-[2-[4,5-dihydro-3-methyl-5-o xo-1-(3-sulfophenyl)-1H-pyrazol-4-y l]diazenyl]-5-methyl-, calcium salt (1:1) Benzenesulfonic acid, 4-[[1-[[(2-methylphenyl)amino]carbonyl]-2-oxopropyl]azo]-3-nitro-, calcium salt (2:1) Benzenesulfonic acid, C10-16-alkyl derivs., calcium salts Benzenesulfonic acid, dodecyl-, branched, calcium salts Benzoic acid, 2-hydroxy-, mono-C14-18-alkyl derivs., calcium salts (2:1) Calcium alginate calcium bis((3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate) Calcium cobalt lead strontium titanium tungsten oxide Calcium disilicide Distillates (petroleum), hydrotreated heavy naphthenic, reaction products with tallow, calcium salts Fatty acids, tallow, calcium salts Fatty acids, vegetable-oil, calcium salts FD&C BLUE NO. 1, CALCIUM LAKE FD&C BLUE NO. 2, CALCIUM LAKE FD&C GREEN NO. 3, CALCIUM LAKE FD&C YELLOW NO. 5, CALCIUM LAKE Formaldehyde, reaction products with tetrapropylenephenol, calcium salts Hydrocarbon waxes, petroleum, oxidized, calcium salts Hydrocarbon waxes, petroleum, oxidized, Me esters, calcium salts Phenol, C12-and C18-30-alkyl, sulfurized, calcium salts, overbased Phenol, dodecyl-, sulfurized, calcium salts Phenol, dodecyl-, sulfurized, carbonates, calcium salts Phenol, tetrapropylene-, sulfurized, calcium salts Phenol, tetrapropylene-, sulfurized, carbonates, calcium salts, overbased Residual oils, petroleum, oxidized, calcium salts Sulfonic acids, petroleum, calcium salts Sulfonic acids, petroleum, calcium salts, overbased Titanate calcium (1:1) Waste solids, calcium sulfate-ash sludges C66H68CaF2N4O10 1155.342 1154.452941981 calcium bis((3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate) calcium bis(atorvastatin(1-)) 9005-35-0 [Ca++].CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1.CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 InChI=1S/2C33H35FN2O5.Ca/c2*1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40;/h2*3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40);/q;;+2/p-2/t2*26-,27-;/m11./s1 FQCKMBLVYCEXJB-MNSAWQCASA-L Organic compounds Organoheterocyclic compounds Pyrroles Substituted pyrroles Diphenylpyrroles Aromatic anilides Aryl fluorides Azacyclic compounds Beta hydroxy acids and derivatives Carbonyl compounds Carboximidic acids Carboxylic acid salts Carboxylic acids Fluorobenzenes Halogenated fatty acids Heteroaromatic compounds Heterocyclic fatty acids Hydrocarbon derivatives Hydroxy fatty acids Medium-chain fatty acids Medium-chain hydroxy acids and derivatives Monocarboxylic acids and derivatives Organic calcium salts Organic metal halides Organic oxides Organic zwitterions Organofluorides Organonitrogen compounds Organopnictogen compounds Propargyl-type 1,3-dipolar organic compounds Pyrrole carboxamides Secondary alcohols Secondary carboxylic acid amides Vinylogous amides 2,3-diphenylpyrrole Alcohol Aromatic anilide Aromatic heteromonocyclic compound Aryl fluoride Aryl halide Azacycle Benzenoid Beta-hydroxy acid Carbonyl group Carboxamide group Carboximidic acid Carboximidic acid derivative Carboxylic acid Carboxylic acid derivative Carboxylic acid salt Fatty acid Fatty acyl Fluorobenzene Halobenzene Halogenated fatty acid Heteroaromatic compound Heterocyclic fatty acid Hydrocarbon derivative Hydroxy acid Hydroxy fatty acid Medium-chain fatty acid Medium-chain hydroxy acid Monocarboxylic acid or derivatives Monocyclic benzene moiety Organic 1,3-dipolar compound Organic calcium salt Organic metal halide Organic nitrogen compound Organic oxide Organic oxygen compound Organic salt Organic zwitterion Organofluoride Organohalogen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Propargyl-type 1,3-dipolar organic compound Pyrrole-3-carboxamide Pyrrole-3-carboxylic acid or derivatives Secondary alcohol Secondary carboxylic acid amide Vinylogous amide organic calcium salt Detected and Not Quantified Calcium alginate Drug Metabolism Action Pathway SMP0144982 logp 6.98 ALOGPS logs -7.15 ALOGPS solubility 8.17e-05 g/l ALOGPS logp 5.39 ChemAxon pka_strongest_acidic 4.33 ChemAxon pka_strongest_basic -2.7 ChemAxon iupac calcium bis((3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate) ChemAxon average_mass 1155.342 ChemAxon mono_mass 1154.452941981 ChemAxon smiles [Ca++].CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1.CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 ChemAxon formula C66H68CaF2N4O10 ChemAxon inchi InChI=1S/2C33H35FN2O5.Ca/c2*1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40;/h2*3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40);/q;;+2/p-2/t2*26-,27-;/m11./s1 ChemAxon inchikey FQCKMBLVYCEXJB-MNSAWQCASA-L ChemAxon polar_surface_area 114.62 ChemAxon refractivity 169.04 ChemAxon polarizability 58.73 ChemAxon rotatable_bond_count 24 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7227398708> DB13372 44630049