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Organic sulfonic acids and derivatives

Organic compounds that consist of sulfonic acid with organic functional group substitutions; includes compounds that are derived from organic sulfonic acids.
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1 Octane Sulfonic Acid Sodium Salt, HPLC Ion Pair Agent, Fisher Chemical™

CAS: 5324-84-5 Molecular Formula: C8H17NaO3S Molecular Weight (g/mol): 216.27 MDL Number: MFCD00007544 InChI Key: HRQDCDQDOPSGBR-UHFFFAOYSA-M IUPAC Name: sodium octane-1-sulfonate SMILES: [Na+].CCCCCCCCS([O-])(=O)=O

CAS 5324-84-5
Molecular Weight (g/mol) 216.27
MDL Number MFCD00007544
SMILES [Na+].CCCCCCCCS([O-])(=O)=O
IUPAC Name sodium octane-1-sulfonate
InChI Key HRQDCDQDOPSGBR-UHFFFAOYSA-M
Molecular Formula C8H17NaO3S
2
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1-Heptanesulfonic Acid Sodium Salt (HPLC), Fisher Chemical™

CAS: 22767-50-6 Molecular Formula: C7H15NaO3S MDL Number: MFCD00007543 InChI Key: REFMEZARFCPESH-UHFFFAOYSA-M PubChem CID: 23672332

PubChem CID 23672332
CAS 22767-50-6
MDL Number MFCD00007543
InChI Key REFMEZARFCPESH-UHFFFAOYSA-M
Molecular Formula C7H15NaO3S
3
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1-Hexanesulfonic Acid Sodium Salt (HPLC), Fisher Chemical™

CAS: 2832-45-3 Molecular Formula: C6H13NaO3S Molecular Weight (g/mol): 188.22 MDL Number: MFCD00007542 InChI Key: QWSZRRAAFHGKCH-UHFFFAOYSA-M Synonym: sodium 1-hexanesulfonate,sodium hexane-1-sulfonate,sodium hexanesulfonate,1-hexanesulfonic acid sodium salt,1-hexanesulfonic acid, sodium salt,1-hexanesulfonic acid, sodium salt 1:1,1-hexane sulfonic acid sodium salt,hexyl sodium sulfonate,1-hexanesulfonate, sodium,hexanesulfonic acid na-salt PubChem CID: 23677630 IUPAC Name: sodium hexane-1-sulfonate SMILES: [Na+].CCCCCCS([O-])(=O)=O

PubChem CID 23677630
CAS 2832-45-3
Molecular Weight (g/mol) 188.22
MDL Number MFCD00007542
SMILES [Na+].CCCCCCS([O-])(=O)=O
Synonym sodium 1-hexanesulfonate,sodium hexane-1-sulfonate,sodium hexanesulfonate,1-hexanesulfonic acid sodium salt,1-hexanesulfonic acid, sodium salt,1-hexanesulfonic acid, sodium salt 1:1,1-hexane sulfonic acid sodium salt,hexyl sodium sulfonate,1-hexanesulfonate, sodium,hexanesulfonic acid na-salt
IUPAC Name sodium hexane-1-sulfonate
InChI Key QWSZRRAAFHGKCH-UHFFFAOYSA-M
Molecular Formula C6H13NaO3S
4
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1-Pentanesulfonic Acid Sodium Salt, Anhydrous (HPLC), Fisher Chemical

CAS: 22767-49-3 Molecular Formula: C5H11NaO3S Molecular Weight (g/mol): 174.19 MDL Number: MFCD00007541,MFCD00149548 InChI Key: ROBLTDOHDSGGDT-UHFFFAOYSA-M Synonym: sodium 1-pentanesulfonate,sodium pentane-1-sulfonate,sodium pentanesulfonate,1-pentanesulfonic acid sodium salt,1-pentanesulfonic acid, sodium salt,1-pentylsodiumsulfonate,ipc-alks-5,1-pentanesulfonate, sodium,pentanesulfonic acid na-salt,pentanesulfonic acidsodiumsalt PubChem CID: 23664617 IUPAC Name: sodium pentane-1-sulfonate SMILES: [Na+].CCCCCS([O-])(=O)=O

PubChem CID 23664617
CAS 22767-49-3
Molecular Weight (g/mol) 174.19
MDL Number MFCD00007541,MFCD00149548
SMILES [Na+].CCCCCS([O-])(=O)=O
Synonym sodium 1-pentanesulfonate,sodium pentane-1-sulfonate,sodium pentanesulfonate,1-pentanesulfonic acid sodium salt,1-pentanesulfonic acid, sodium salt,1-pentylsodiumsulfonate,ipc-alks-5,1-pentanesulfonate, sodium,pentanesulfonic acid na-salt,pentanesulfonic acidsodiumsalt
IUPAC Name sodium pentane-1-sulfonate
InChI Key ROBLTDOHDSGGDT-UHFFFAOYSA-M
Molecular Formula C5H11NaO3S
5
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Sulfanilic Acid Anhydrous (Crystalline/Certified ACS), Fisher Chemical

CAS: 121-57-3 Molecular Formula: C6H7NO3S Molecular Weight (g/mol): 173.186 MDL Number: MFCD00007886 InChI Key: HVBSAKJJOYLTQU-UHFFFAOYSA-N Synonym: sulfanilic acid,sulphanilic acid,p-aminobenzenesulfonic acid,sulfanilsaeure,aniline-4-sulfonic acid,benzenesulfonic acid, 4-amino,aniline-p-sulfonic acid,aniline-p-sulphonic acid,p-aminophenylsulfonic acid,sulfanilicacid PubChem CID: 8479 ChEBI: CHEBI:27500 IUPAC Name: 4-aminobenzenesulfonic acid SMILES: C1=CC(=CC=C1N)S(=O)(=O)O

PubChem CID 8479
CAS 121-57-3
Molecular Weight (g/mol) 173.186
ChEBI CHEBI:27500
MDL Number MFCD00007886
SMILES C1=CC(=CC=C1N)S(=O)(=O)O
Synonym sulfanilic acid,sulphanilic acid,p-aminobenzenesulfonic acid,sulfanilsaeure,aniline-4-sulfonic acid,benzenesulfonic acid, 4-amino,aniline-p-sulfonic acid,aniline-p-sulphonic acid,p-aminophenylsulfonic acid,sulfanilicacid
IUPAC Name 4-aminobenzenesulfonic acid
InChI Key HVBSAKJJOYLTQU-UHFFFAOYSA-N
Molecular Formula C6H7NO3S
6

Benzenesulfonic acid, sodium salt, 98%

CAS: 515-42-4 Molecular Formula: C6H5NaO3S Molecular Weight (g/mol): 180.16 MDL Number: MFCD00065179 InChI Key: MZSDGDXXBZSFTG-UHFFFAOYSA-M Synonym: sodium benzenesulfonate,benzenesulfonic acid sodium salt,benzenesulfonic acid, sodium salt,dispersant gn,sodium phenylsulfonate,sodium benzenesulphonate,sodium benzene sulfonate,sodium benzene monosulfate,unii-k5rm14azhx,sodium benzene monosulfonate PubChem CID: 517327 IUPAC Name: sodium;benzenesulfonate SMILES: C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]

PubChem CID 517327
CAS 515-42-4
Molecular Weight (g/mol) 180.16
MDL Number MFCD00065179
SMILES C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]
Synonym sodium benzenesulfonate,benzenesulfonic acid sodium salt,benzenesulfonic acid, sodium salt,dispersant gn,sodium phenylsulfonate,sodium benzenesulphonate,sodium benzene sulfonate,sodium benzene monosulfate,unii-k5rm14azhx,sodium benzene monosulfonate
IUPAC Name sodium;benzenesulfonate
InChI Key MZSDGDXXBZSFTG-UHFFFAOYSA-M
Molecular Formula C6H5NaO3S
7

Gallium(III) trifluoromethanesulfonate, 99%

CAS: 74974-60-0 Molecular Formula: C3F9GaO9S3 Molecular Weight (g/mol): 516.91 MDL Number: MFCD02093898 InChI Key: BVLXNPRUOXPBII-UHFFFAOYSA-K Synonym: gallium iii trifluoromethanesulfonate,gallium tris trifluoromethanesulfonate,gallium trifluoromethanesulfonate,gallium triflate,gallium iii trifluoromethanesulphonate,methanesulfonic acid, trifluoro-, gallium salt,galium iii triflate,gallium iii triflate,gallium 3+ ion tritriflate,gallium tris fluoranyl methanesulfonate PubChem CID: 2733940 IUPAC Name: gallium;trifluoromethanesulfonate SMILES: C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Ga+3]

PubChem CID 2733940
CAS 74974-60-0
Molecular Weight (g/mol) 516.91
MDL Number MFCD02093898
SMILES C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Ga+3]
Synonym gallium iii trifluoromethanesulfonate,gallium tris trifluoromethanesulfonate,gallium trifluoromethanesulfonate,gallium triflate,gallium iii trifluoromethanesulphonate,methanesulfonic acid, trifluoro-, gallium salt,galium iii triflate,gallium iii triflate,gallium 3+ ion tritriflate,gallium tris fluoranyl methanesulfonate
IUPAC Name gallium;trifluoromethanesulfonate
InChI Key BVLXNPRUOXPBII-UHFFFAOYSA-K
Molecular Formula C3F9GaO9S3
8

Sodium 2-bromoethanesulfonate, 98%

CAS: 4263-52-9 Molecular Formula: C2H4BrNaO3S Molecular Weight (g/mol): 211.005 MDL Number: MFCD00007530 InChI Key: HNFOAHXBHLWKNF-UHFFFAOYSA-M Synonym: sodium 2-bromoethanesulfonate,2-bromoethanesulfonic acid sodium salt,sodium 2-bromoethanesulphonate,2-bromoethanesulfonic acid, sodium salt,sodium bromoethylsulfonate,ethanesulfonic acid, 2-bromo-, sodium salt,ethanesulfonic acid, 2-bromo-, sodium salt 1:1,sodium 2-bromoethane sulfonate,2-bromoethanesulfonic acid sodium,natrium-2-bromethansulfonat PubChem CID: 23666797 IUPAC Name: sodium;2-bromoethanesulfonate SMILES: C(CBr)S(=O)(=O)[O-].[Na+]

PubChem CID 23666797
CAS 4263-52-9
Molecular Weight (g/mol) 211.005
MDL Number MFCD00007530
SMILES C(CBr)S(=O)(=O)[O-].[Na+]
Synonym sodium 2-bromoethanesulfonate,2-bromoethanesulfonic acid sodium salt,sodium 2-bromoethanesulphonate,2-bromoethanesulfonic acid, sodium salt,sodium bromoethylsulfonate,ethanesulfonic acid, 2-bromo-, sodium salt,ethanesulfonic acid, 2-bromo-, sodium salt 1:1,sodium 2-bromoethane sulfonate,2-bromoethanesulfonic acid sodium,natrium-2-bromethansulfonat
IUPAC Name sodium;2-bromoethanesulfonate
InChI Key HNFOAHXBHLWKNF-UHFFFAOYSA-M
Molecular Formula C2H4BrNaO3S
9

(S)-(+)-Glycidyl nosylate, 98%

CAS: 115314-14-2 Molecular Formula: C9H9NO6S Molecular Weight (g/mol): 259.23 MDL Number: MFCD00064582 InChI Key: AIHIHVZYAAMDPM-QMMMGPOBSA-N Synonym: s-+-glycidyl nosylate,s-glycidyl nosylate,s-glycidyl 3-nitrobenzenesulfonate,s-oxiran-2-ylmethyl 3-nitrobenzenesulfonate,s-+-glycidyl 3-nitrobenzenesulfonate,glycidyl 3-nitrobenzenesulfonate,ccris 6394,2s-+-glycidyl-3-nitrobenzenesulfonate,oxiranylmethyl s-3-nitrobenzenesulfonate,2s-oxiran-2-yl methyl 3-nitrobenzenesulfonate PubChem CID: 146490 IUPAC Name: [(2S)-oxiran-2-yl]methyl 3-nitrobenzenesulfonate SMILES: [O-][N+](=O)C1=CC=CC(=C1)S(=O)(=O)OC[C@@H]1CO1

PubChem CID 146490
CAS 115314-14-2
Molecular Weight (g/mol) 259.23
MDL Number MFCD00064582
SMILES [O-][N+](=O)C1=CC=CC(=C1)S(=O)(=O)OC[C@@H]1CO1
Synonym s-+-glycidyl nosylate,s-glycidyl nosylate,s-glycidyl 3-nitrobenzenesulfonate,s-oxiran-2-ylmethyl 3-nitrobenzenesulfonate,s-+-glycidyl 3-nitrobenzenesulfonate,glycidyl 3-nitrobenzenesulfonate,ccris 6394,2s-+-glycidyl-3-nitrobenzenesulfonate,oxiranylmethyl s-3-nitrobenzenesulfonate,2s-oxiran-2-yl methyl 3-nitrobenzenesulfonate
IUPAC Name [(2S)-oxiran-2-yl]methyl 3-nitrobenzenesulfonate
InChI Key AIHIHVZYAAMDPM-QMMMGPOBSA-N
Molecular Formula C9H9NO6S
10

(R)-(-)-Glycidyl nosylate, 98%

CAS: 115314-17-5 Molecular Formula: C9H9NO6S Molecular Weight (g/mol): 259.23 MDL Number: MFCD00013436 InChI Key: AIHIHVZYAAMDPM-MRVPVSSYSA-N Synonym: r---glycidyl nosylate,r-glycidyl nosylate,r-oxiran-2-ylmethyl 3-nitrobenzenesulfonate,r-glycidyl 3-nitrobenzenesulfonate,r---glycidyl 3-nitrobenzenesulfonate,r---glycidyl-3-nitrobenzenesulfonate,ccris 6393,oxiranylmethyl r-3-nitrobenzenesulfonate,benzenesulfonic acid, 3-nitro-, oxiranylmethyl ester, r PubChem CID: 146513 IUPAC Name: [(2R)-oxiran-2-yl]methyl 3-nitrobenzenesulfonate SMILES: C1C(O1)COS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

PubChem CID 146513
CAS 115314-17-5
Molecular Weight (g/mol) 259.23
MDL Number MFCD00013436
SMILES C1C(O1)COS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]
Synonym r---glycidyl nosylate,r-glycidyl nosylate,r-oxiran-2-ylmethyl 3-nitrobenzenesulfonate,r-glycidyl 3-nitrobenzenesulfonate,r---glycidyl 3-nitrobenzenesulfonate,r---glycidyl-3-nitrobenzenesulfonate,ccris 6393,oxiranylmethyl r-3-nitrobenzenesulfonate,benzenesulfonic acid, 3-nitro-, oxiranylmethyl ester, r
IUPAC Name [(2R)-oxiran-2-yl]methyl 3-nitrobenzenesulfonate
InChI Key AIHIHVZYAAMDPM-MRVPVSSYSA-N
Molecular Formula C9H9NO6S
11

Sodium 1-octanesulfonate, 99%

CAS: 5324-84-5 Molecular Formula: C8H17NaO3S Molecular Weight (g/mol): 216.27 MDL Number: MFCD00007544 InChI Key: HRQDCDQDOPSGBR-UHFFFAOYSA-M Synonym: sodium 1-octanesulfonate,sodium octane-1-sulfonate,1-octanesulfonic acid sodium salt,sodium octanesulfonate,1-octanesulfonic acid, sodium salt,1-octanesulfonate, sodium,sodium octylsulfonate,unii-j46ez5jyb3,octyl sodium sulfonate,ipc-alks-8 PubChem CID: 23669624 IUPAC Name: sodium;octane-1-sulfonate SMILES: [Na+].CCCCCCCCS([O-])(=O)=O

PubChem CID 23669624
CAS 5324-84-5
Molecular Weight (g/mol) 216.27
MDL Number MFCD00007544
SMILES [Na+].CCCCCCCCS([O-])(=O)=O
Synonym sodium 1-octanesulfonate,sodium octane-1-sulfonate,1-octanesulfonic acid sodium salt,sodium octanesulfonate,1-octanesulfonic acid, sodium salt,1-octanesulfonate, sodium,sodium octylsulfonate,unii-j46ez5jyb3,octyl sodium sulfonate,ipc-alks-8
IUPAC Name sodium;octane-1-sulfonate
InChI Key HRQDCDQDOPSGBR-UHFFFAOYSA-M
Molecular Formula C8H17NaO3S
12

Thermo Scientific Chemicals Barium diphenylaminesulfonate, pure, indicator grade

CAS: 6211-24-1 Molecular Formula: C24H20BaN2O6S2 Molecular Weight (g/mol): 633.88 MDL Number: MFCD00007497 InChI Key: IVCNVXFNTKXMCA-UHFFFAOYSA-L Synonym: barium diphenylamine-4-sulfonate,barium diphenylaminesulfonate,benzenesulfonic acid, 4-phenylamino-, barium salt 2:1,barium bis 4-anilinobenzenesulphonate,barium diphenylamine sulfonate,n-phenylsufanilic acid barium,unii-ssj5f79159,diphenylamine-4-sulfonic acid barium salt,n-phenylsufanilic acid, barium salt,4-anilinobenzenesulfonate; barium 2+ PubChem CID: 80342 IUPAC Name: 4-anilinobenzenesulfonate;barium(2+) SMILES: [Ba++].[O-]S(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1.[O-]S(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1

PubChem CID 80342
CAS 6211-24-1
Molecular Weight (g/mol) 633.88
MDL Number MFCD00007497
SMILES [Ba++].[O-]S(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1.[O-]S(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1
Synonym barium diphenylamine-4-sulfonate,barium diphenylaminesulfonate,benzenesulfonic acid, 4-phenylamino-, barium salt 2:1,barium bis 4-anilinobenzenesulphonate,barium diphenylamine sulfonate,n-phenylsufanilic acid barium,unii-ssj5f79159,diphenylamine-4-sulfonic acid barium salt,n-phenylsufanilic acid, barium salt,4-anilinobenzenesulfonate; barium 2+
IUPAC Name 4-anilinobenzenesulfonate;barium(2+)
InChI Key IVCNVXFNTKXMCA-UHFFFAOYSA-L
Molecular Formula C24H20BaN2O6S2
13

Sodium 4-hydroxybenzenesulfonate dihydrate, 97%

CAS: 10580-19-5 Molecular Formula: C6H5O4S Molecular Weight (g/mol): 173.16 MDL Number: MFCD00044734,MFCD00150724 InChI Key: FEPBITJSIHRMRT-UHFFFAOYSA-M Synonym: sodium 4-hydroxybenzenesulfonate dihydrate,unii-5nh81n759q,phenol-4-sulfonic acid sodium salt dihydrate,4-hydroxybenzenesulfonic acid sodium salt dihydrate,benzenesulfonic acid, 4-hydroxy-, monosodium salt, dihydrate,4-hydroxybenzenesulfonic acid sodium salt,sodium 4-hydroxybenzene-1-sulfonate dihydrate,phenolsulphonate sodium usp,acmc-2098hs,sodium p-phenolsulfonate dihydrate PubChem CID: 23666329 IUPAC Name: sodium;4-hydroxybenzenesulfonate;dihydrate SMILES: OC1=CC=C(C=C1)S([O-])(=O)=O

PubChem CID 23666329
CAS 10580-19-5
Molecular Weight (g/mol) 173.16
MDL Number MFCD00044734,MFCD00150724
SMILES OC1=CC=C(C=C1)S([O-])(=O)=O
Synonym sodium 4-hydroxybenzenesulfonate dihydrate,unii-5nh81n759q,phenol-4-sulfonic acid sodium salt dihydrate,4-hydroxybenzenesulfonic acid sodium salt dihydrate,benzenesulfonic acid, 4-hydroxy-, monosodium salt, dihydrate,4-hydroxybenzenesulfonic acid sodium salt,sodium 4-hydroxybenzene-1-sulfonate dihydrate,phenolsulphonate sodium usp,acmc-2098hs,sodium p-phenolsulfonate dihydrate
IUPAC Name sodium;4-hydroxybenzenesulfonate;dihydrate
InChI Key FEPBITJSIHRMRT-UHFFFAOYSA-M
Molecular Formula C6H5O4S
14

Sodium trifluoromethanesulfonate, 98%

CAS: 2926-30-9 Molecular Formula: CF3NaO3S Molecular Weight (g/mol): 172.05 MDL Number: MFCD00061607 InChI Key: XGPOMXSYOKFBHS-UHFFFAOYSA-M Synonym: sodium trifluoromethanesulfonate,sodium triflate,trifluoromethanesulfonic acid sodium salt,sodium trifluoro methane sulfonate,methanesulfonic acid, trifluoro-, sodium salt,pubchem23598,cf3so3na,acmc-1cfau,sodiumtrifluoromethanesulfonate,ksc491a1d PubChem CID: 23676748 IUPAC Name: sodium;trifluoromethanesulfonate SMILES: C(F)(F)(F)S(=O)(=O)[O-].[Na+]

PubChem CID 23676748
CAS 2926-30-9
Molecular Weight (g/mol) 172.05
MDL Number MFCD00061607
SMILES C(F)(F)(F)S(=O)(=O)[O-].[Na+]
Synonym sodium trifluoromethanesulfonate,sodium triflate,trifluoromethanesulfonic acid sodium salt,sodium trifluoro methane sulfonate,methanesulfonic acid, trifluoro-, sodium salt,pubchem23598,cf3so3na,acmc-1cfau,sodiumtrifluoromethanesulfonate,ksc491a1d
IUPAC Name sodium;trifluoromethanesulfonate
InChI Key XGPOMXSYOKFBHS-UHFFFAOYSA-M
Molecular Formula CF3NaO3S
15

Aniline-2,5-disulfonic acid, 95%

CAS: 98-44-2 Molecular Formula: C6H7NO6S2 Molecular Weight (g/mol): 253.243 MDL Number: MFCD00035753 InChI Key: LDCCBULMAFILCT-UHFFFAOYSA-N Synonym: 2-amino-1,4-benzenedisulfonic acid,aniline-2,5-disulfonic acid,2,5-disulfoaniline,4-sulfometanilic acid,1,4-benzenedisulfonic acid, 2-amino,2,5-disulfo-1-aminobenzene,2-amino-1,4-disulfobenzene,1-anilino-2,5-disulfonic acid,2-amino-p-benzenedisulfonic acid,unii-5e2ot6t2ps PubChem CID: 60988 IUPAC Name: 2-aminobenzene-1,4-disulfonic acid SMILES: C1=CC(=C(C=C1S(=O)(=O)O)N)S(=O)(=O)O

PubChem CID 60988
CAS 98-44-2
Molecular Weight (g/mol) 253.243
MDL Number MFCD00035753
SMILES C1=CC(=C(C=C1S(=O)(=O)O)N)S(=O)(=O)O
Synonym 2-amino-1,4-benzenedisulfonic acid,aniline-2,5-disulfonic acid,2,5-disulfoaniline,4-sulfometanilic acid,1,4-benzenedisulfonic acid, 2-amino,2,5-disulfo-1-aminobenzene,2-amino-1,4-disulfobenzene,1-anilino-2,5-disulfonic acid,2-amino-p-benzenedisulfonic acid,unii-5e2ot6t2ps
IUPAC Name 2-aminobenzene-1,4-disulfonic acid
InChI Key LDCCBULMAFILCT-UHFFFAOYSA-N
Molecular Formula C6H7NO6S2