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Organic sulfonic acids and derivatives
Description:
Compounds containing a sulfonic acid or derivative, with the general structure RS(=O)2X (R= H or organyl group, X=any heteroatom).
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Acamprosate-d3calciumCas Number: 1225580-94-8 Compound CID: 49849534Formula: C5H7D3CaNO4S+ Molecular Weight: 2183.224008IUPAC Name: calcium;3-[(2,2,2-trideuterioacetyl)amino]propane-1-sulfonateSMILES: CC(=O)NCCCS(=O)(=O)[O-].[Ca+2]InChIKey: WPEXQWVYZZXPJW-NIIDSAIPSA-MInChI: InChI=1S/C5H11NO4S.Ca/c1-5(7)6-3-2-4-11(8,9)10;/h2-4H2,1H3,(H,6,7)(H,8,9,10);/q;+2/p-1/i1D3; -
Sodium 1-octanesulfonateCas Number: 5324-84-5 EC Number: 226-195-4Formula: C8H17O3SNa Molecular Weight: 216.27IUPAC Name: sodium;octane-1-sulfonateSMILES: CCCCCCCCS(=O)(=O)[O-].[Na+]InChIKey: HRQDCDQDOPSGBR-UHFFFAOYSA-MInChI: InChI=1S/C8H18O3S.Na/c1-2-3-4-5-6-7-8-12(9,10)11;/h2-8H2,1H3,(H,9,10,11);/q;+1/p-1Synonyms: Sodium 1-octanesulfonate|5324-84-5|sodium octane-1-sulfonate|1-Octanesulfonic acid sodium salt|Sodium caprylyl sulfon...
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Sodium 1-heptanesulfonateFormula: C7H15O3SNa Molecular Weight: 202.25IUPAC Name: sodium;heptane-1-sulfonateSMILES: CCCCCCCS(=O)(=O)[O-].[Na+]InChIKey: REFMEZARFCPESH-UHFFFAOYSA-MInChI: InChI=1S/C7H16O3S.Na/c1-2-3-4-5-6-7-11(8,9)10;/h2-7H2,1H3,(H,8,9,10);/q;+1/p-1Synonyms: Sodium 1-heptanesulfonate, Vetec(TM) reagent grade | 1-Heptanesulfonic acid, sodium salt (1:1) | FT-0607875 | Heptyls...
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oxetane-3-sulfonamideFormula: C3H7NO3S Molecular Weight: 137.15IUPAC Name: oxetane-3-sulfonamideSMILES: C1C(CO1)S(=O)(=O)NInChIKey: UMRKNFYJEVIMLC-UHFFFAOYSA-NInChI: InChI=1S/C3H7NO3S/c4-8(5,6)3-1-7-2-3/h3H,1-2H2,(H2,4,5,6)Synonyms: SY189614 | AKOS026727435 | CS-0217544 | oxetane-3-sulfonamide | PS-17894 | EN300-76723 | MFCD18838843 | SCHEMBL187096...
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pentane-1-sulfonamideCas Number: 52960-14-2 Compound CID: 10920696Formula: C5H13NO2S Molecular Weight: 151.23IUPAC Name: pentane-1-sulfonamideSMILES: CCCCCS(=O)(=O)NInChIKey: ICFQGMYPBURXAZ-UHFFFAOYSA-NInChI: InChI=1S/C5H13NO2S/c1-2-3-4-5-9(6,7)8/h2-5H2,1H3,(H2,6,7,8)Synonyms: AKOS010295431 | MFCD09800672 | n-pentanesulfonamide | SCHEMBL30578 | ICFQGMYPBURXAZ-UHFFFAOYSA-N | N-Pentylsulfonamid...
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N-methylpyrrolidine-3-sulfonamide;hydrochlorideCas Number: 1423025-73-3 Compound CID: 71756912Formula: C5H12N2O2S.HCl Molecular Weight: 200.68IUPAC Name: N-methylpyrrolidine-3-sulfonamide;hydrochlorideSMILES: CNS(=O)(=O)C1CCNC1.ClInChIKey: CRGGNLRXPUGCNI-UHFFFAOYSA-NInChI: InChI=1S/C5H12N2O2S.ClH/c1-6-10(8,9)5-2-3-7-4-5;/h5-7H,2-4H2,1H3;1HSynonyms: N-methylpyrrolidine-3-sulfonamide hydrochloride | 1423025-73-3 | N-methylpyrrolidine-3-sulfonamide | hydrochloride | ...
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trans-N-(4-formylcyclohexyl)methanesulfonamideCas Number: 2169920-24-3 Compound CID: 87723912Formula: C8H15NO3S Molecular Weight: 205.27IUPAC Name: N-(4-formylcyclohexyl)methanesulfonamideSMILES: CS(=O)(=O)NC1CCC(CC1)C=OInChIKey: BDBDRUVLKWOEDN-UHFFFAOYSA-NInChI: InChI=1S/C8H15NO3S/c1-13(11,12)9-8-4-2-7(6-10)3-5-8/h6-9H,2-5H2,1H3Synonyms: 2169920-24-3 | trans-N-(4-formylcyclohexyl)methanesulfonamide | N-(4-Formylcyclohexyl)methanesulfonamide | N-[trans-4...
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4-iodo-1,5-dimethyl-pyrazole-3-sulfonamideCas Number: 2250242-05-6 Compound CID: 138110104Formula: C5H8N3O2SI Molecular Weight: 301.1IUPAC Name: 4-iodo-1,5-dimethylpyrazole-3-sulfonamideSMILES: CC1=C(C(=NN1C)S(=O)(=O)N)IInChIKey: OTLKOWBMULAWAZ-UHFFFAOYSA-NInChI: InChI=1S/C5H8IN3O2S/c1-3-4(6)5(8-9(3)2)12(7,10)11/h1-2H3,(H2,7,10,11)Synonyms: 4-IODO-1,5-DIMETHYL-PYRAZOLE-3-SULFONAMIDE | 2250242-05-6 | 4-Iodo-1,5-dimethyl-1H-pyrazole-3-sulfonamide | MFCD31697...
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azetidine-3-sulfonamide;hydrochlorideIUPAC Name: azetidine-3-sulfonamide;hydrochlorideSMILES: C1C(CN1)S(=O)(=O)N.ClInChIKey: HLFSKAALRXWDTD-UHFFFAOYSA-NInChI: InChI=1S/C3H8N2O2S.ClH/c4-8(6,7)3-1-5-2-3;/h3,5H,1-2H2,(H2,4,6,7);1HSynonyms: azetidine-3-sulfonamide;hydrochloride | SY208968 | azetidine-3-sulfonamidehydrochloride | SCHEMBL20609915 | 3-Azetidi...
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Trans-[4-(methylamino)cyclohexyl]methanesulfonic acidCas Number: 2124221-12-9 Compound CID: 130297570Formula: C8H17NO3S Molecular Weight: 207.29IUPAC Name: [4-(methylamino)cyclohexyl]methanesulfonic acidSMILES: CNC1CCC(CC1)CS(=O)(=O)OInChIKey: VFGKCJQWKDYLOI-UHFFFAOYSA-NInChI: InChI=1S/C8H17NO3S/c1-9-8-4-2-7(3-5-8)6-13(10,11)12/h7-9H,2-6H2,1H3,(H,10,11,12)Synonyms: Trans-[4-(methylamino)cyclohexyl]methanesulfonic acid | 2124221-12-9 | trans-(4-(Methylamino)cyclohexyl)methanesulfon...
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1-(cyclopropanesulfonyl)azetidin-3-olCas Number: 1187594-22-4 Compound CID: 57868875Formula: C6H11NO3S Molecular Weight: 177.22IUPAC Name: 1-cyclopropylsulfonylazetidin-3-olSMILES: C1CC1S(=O)(=O)N2CC(C2)OInChIKey: LOWQTVFLKFHRPF-UHFFFAOYSA-NInChI: InChI=1S/C6H11NO3S/c8-5-3-7(4-5)11(9,10)6-1-2-6/h5-6,8H,1-4H2Synonyms: 1-(cyclopropanesulfonyl)azetidin-3-ol | 1187594-22-4 | 1-(cyclopropylsulfonyl)azetidin-3-ol | SCHEMBL873177 | MFCD203...
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1,5-dimethyl-1H-pyrazole-4-sulfonamideCas Number: 88398-55-4 Compound CID: 13342781Formula: C5H9N3O2S Molecular Weight: 175.21IUPAC Name: 1,5-dimethylpyrazole-4-sulfonamideSMILES: CC1=C(C=NN1C)S(=O)(=O)NInChIKey: UQWGJSMSRNAREF-UHFFFAOYSA-NInChI: InChI=1S/C5H9N3O2S/c1-4-5(11(6,9)10)3-7-8(4)2/h3H,1-2H3,(H2,6,9,10)Synonyms: MFCD07057501 | 1,5-DIMETHYLPYRAZOLE-4-SULFONAMIDE | PB48006 | SY198238 | 1H-Pyrazole-4-sulfonamide, 1,5-dimethyl- | Z...
