Unclassified Organic Compounds

1,3-Cyclohexanedione, 97%, may cont. up to 1% NaCl

CAS: 504-02-9 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.128 MDL Number: MFCD00001585 InChI Key: HJSLFCCWAKVHIW-UHFFFAOYSA-N Synonym: 1,3-cyclohexanedione,dihydroresorcinol,1,3-cyclohexandione,1,3 cyclohexanedione,hydroresorcinol,resorcinol, dihydro,1,3-cyclohexanone,unii-6uk3d2bxjt,1,3-benzenediol, dihydro,1,3-cyclohexane dione PubChem CID: 10434 ChEBI: CHEBI:17766 IUPAC Name: cyclohexane-1,3-dione SMILES: C1CC(=O)CC(=O)C1

Fluorescein disodium salt

CAS: 518-47-8 Molecular Formula: C20H10Na2O5 Molecular Weight (g/mol): 376.28 MDL Number: MFCD00167039 InChI Key: NJDNXYGOVLYJHP-UHFFFAOYSA-L Synonym: Acid Yellow 73; C.I. 45350 IUPAC Name: disodium 2-(6-oxido-3-oxo-3H-xanthen-9-yl)benzoate SMILES: [Na+].[Na+].[O-]C(=O)C1=CC=CC=C1C1=C2C=CC(=O)C=C2OC2=CC([O-])=CC=C12

Thermo Scientific™ Parecoxib sodium salt

CAS: 198470-85-8 Molecular Formula: C₁₉H₁₇N₂NaO₄S Molecular Weight (g/mol): 392.4

Dantrolene sodium salt

CAS: 14663-23-1 Molecular Formula: C14H12N4NaO5 Molecular Weight (g/mol): 339.263 MDL Number: MFCD00079130 InChI Key: XHONPQLVCHTEDY-YVCISUPJSA-N PubChem CID: 131674048 IUPAC Name: molecular hydrogen;1-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]imidazolidine-2,4-dione;sodium SMILES: [HH].C1C(=O)NC(=O)N1N=CC2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-].[Na]

Sulfonazo III salt

CAS: 68504-35-8 Molecular Formula: C22H16N4Na4O14S4 Molecular Weight (g/mol): 780.583 MDL Number: MFCD00003942 InChI Key: WHVMUCGHHVLOCE-FMNKGCAFSA-N Synonym: Tetrasodium 4,5-dihydroxy-3,6-bis[(2-sulfonatophenyl)azo]naphthalene-2,7-disulfonate PubChem CID: 131857569 IUPAC Name: (3E,6E)-4,5-dioxo-3,6-bis[(2-sulfophenyl)hydrazinylidene]naphthalene-2,7-disulfonic acid;sodium SMILES: C1=CC=C(C(=C1)NN=C2C(=CC3=C(C2=O)C(=O)C(=NNC4=CC=CC=C4S(=O)(=O)O)C(=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O.[Na].[Na].[Na].[Na]

Moxalactam sodium salt

CAS: 64953-12-4 Molecular Formula: C20H18N6Na2O9S Molecular Weight (g/mol): 564.44 InChI Key: GRIXGZQULWMCLU-UHFFFAOYNA-L IUPAC Name: disodium 7-[2-carboxylato-2-(4-hydroxyphenyl)acetamido]-7-methoxy-3-{[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]methyl}-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate SMILES: [Na+].[Na+].COC1(NC(=O)C(C([O-])=O)C2=CC=C(O)C=C2)C2OCC(CSC3=NN=NN3C)=C(N2C1=O)C([O-])=O

Dicloxacillin sodium salt monohydrate

CAS: 13412-64-1 Molecular Formula: C19H21Cl2N3NaO6S Molecular Weight (g/mol): 513.342 MDL Number: MFCD00056865 InChI Key: ASMFXKXNAWVTAY-MBGFYOAHSA-N PubChem CID: 131673926 IUPAC Name: (2S,5R,6R)-6-[[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;molecular hydrogen;sodium;hydrate SMILES: [HH].CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)O.O.[Na]

Thermo Scientific™ Ibandronate sodium salt monohydrate

CAS: 138926-19-9 Molecular Formula: C9H24NNaO8P2 Molecular Weight (g/mol): 359.23 InChI Key: VBDRTGFACFYFCT-UHFFFAOYNA-M IUPAC Name: sodium hydrate hydrogen {1-hydroxy-3-[methyl(pentyl)amino]-1-phosphonopropyl}phosphonate SMILES: O.[Na+].CCCCCN(C)CCC(O)(P(O)(O)=O)P(O)([O-])=O

Thermo Scientific™ Pravastatin sodium salt hydrate

CAS: 2244386-63-6 Molecular Formula: C₂₃H₃₅O₇Na·xH₂O Molecular Weight (g/mol): 446.51

Carbenoxolone disodium salt, 97+%

CAS: 7421-40-1 Molecular Formula: C34H48Na2O7 Molecular Weight (g/mol): 614.73 MDL Number: MFCD00079043 InChI Key: BQENDLAVTKRQMS-SBBGFIFASA-L Synonym: carbenoxolone disodium salt,disodium 3beta-3-3-carboxylatopropanoyl oxy-11-oxoolean-12-en-30-oate,disodium 4as,6as,6br,10s,12as,12br,14br-10-3-carboxylatopropanoyl oxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,7,8,8a,10,11,12,12b,14b-dodecahydro-1h-picene-2-carboxylate PubChem CID: 133687779 IUPAC Name: disodium;(2R,4aR,6aS,6aR,6bS,8aS,10R,12aR,14bS)-10-(3-carboxylatopropanoyloxy)-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylate SMILES: [Na+].[Na+].[H][C@@]12C[C@](C)(CC[C@]1(C)CC[C@]1(C)C2=CC(=O)[C@]2([H])[C@@]3(C)CC[C@H](OC(=O)CCC([O-])=O)C(C)(C)[C@]3([H])CC[C@@]12C)C([O-])=O

Thermo Scientific Chemicals Fluorescein disodium salt hydrate

CAS: 518-47-8 Molecular Formula: C20H10Na2O5 Molecular Weight (g/mol): 376.28 MDL Number: MFCD00167039 InChI Key: NJDNXYGOVLYJHP-UHFFFAOYSA-L Synonym: Acid Yellow 73; C.I. 45350 IUPAC Name: disodium 2-(6-oxido-3-oxo-3H-xanthen-9-yl)benzoate SMILES: [Na+].[Na+].[O-]C(=O)C1=CC=CC=C1C1=C2C=CC(=O)C=C2OC2=CC([O-])=CC=C12

Rosuvastatin, calcium salt, 98%

CAS: 147098-20-2 Molecular Formula: C₂₂H₂₈FN₃O₆S·₁/₂Ca Molecular Weight (g/mol): 500.58 InChI Key: LQFSLFAVBQEFBH-LSMDDVBQSA-N Synonym: 3s,5r-rosuvastatin calcium salt, ent-rosuvastatin PubChem CID: 131673834 IUPAC Name: calcium;(E,3R,5S)-7-[4-(4-fluorophenyl)-2-[methyl(methylsulfonyl)amino]-6-propan-2-ylpyrimidin-5-yl]-3,5-dihydroxyhept-6-enoic acid;molecular hydrogen SMILES: [HH].[HH].CC(C)C1=NC(=NC(=C1C=CC(CC(CC(=O)O)O)O)C2=CC=C(C=C2)F)N(C)S(=O)(=O)C.CC(C)C1=NC(=NC(=C1C=CC(CC(CC(=O)O)O)O)C2=CC=C(C=C2)F)N(C)S(=O)(=O)C.[Ca]

Thermo Scientific Chemicals (-)-Epinephrine (+)-bitartrate salt, 98+%

CAS: 51-42-3 Molecular Formula: C13H19NO9 Molecular Weight (g/mol): 333.29 MDL Number: MFCD00035077 InChI Key: YLXIPWWIOISBDD-NDAAPVSOSA-N Synonym: L-Adrenaline (+)-bitartrate salt,L-Adrenaline D-hydrogentartrate PubChem CID: 124080922 SMILES: O[C@H]([C@@H](O)C(O)=O)C(O)=O.CNC[C@H](O)C1=CC=C(O)C(O)=C1

Sulforhodamine B sodium salt

CAS: 3520-42-1 Molecular Formula: C29H33N2NaO7S2 Molecular Weight (g/mol): 608.70 MDL Number: MFCD00010180 InChI Key: XJENLUNLXRJLEZ-UHFFFAOYSA-M Synonym: C.I. 45100; Kiton Red S PubChem CID: 131852807 IUPAC Name: 2-[3-(diethylamino)-6-diethylazaniumylidenexanthen-9-yl]-5-sulfobenzenesulfonate;sodium SMILES: [Na+].CCN(CC)C1=CC2=[O+]C3=CC(N(CC)CC)=C(C)C=C3C(C3=CC=C(C=C3S([O-])(=O)=O)S([O-])(=O)=O)=C2C=C1C

Nigericin sodium salt, 98+%