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-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

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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

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

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Specifications

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

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

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Specifications

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

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

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Specifications

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

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

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Specifications

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

1-(Ethylsulfonyl)piperazine, 97%, Thermo Scientific™

CAS: 62937-96-6 Molecular Formula: C6H14N2O2S Molecular Weight (g/mol): 178.25 MDL Number: MFCD02093528 InChI Key: BIYGAOBOLDXNHM-UHFFFAOYSA-N Synonym: 1-ethylsulfonyl piperazine,1-ethylsulphonyl piperazine,1-ethanesulfonyl piperazine,1-ethylsulfonyl-piperazine,1-ethanesulfonyl-piperazine,1-ethanesulfonylpiperazine,ethylsulfonyl piperazine,ethanesulfonylpiperazine,ethanesulfonyl-piperazine PubChem CID: 415294 IUPAC Name: 1-ethylsulfonylpiperazine SMILES: CCS(=O)(=O)N1CCNCC1

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Specifications

PubChem CID	415294
CAS	62937-96-6
Molecular Weight (g/mol)	178.25
MDL Number	MFCD02093528
SMILES	CCS(=O)(=O)N1CCNCC1
Synonym	1-ethylsulfonyl piperazine,1-ethylsulphonyl piperazine,1-ethanesulfonyl piperazine,1-ethylsulfonyl-piperazine,1-ethanesulfonyl-piperazine,1-ethanesulfonylpiperazine,ethylsulfonyl piperazine,ethanesulfonylpiperazine,ethanesulfonyl-piperazine
IUPAC Name	1-ethylsulfonylpiperazine
InChI Key	BIYGAOBOLDXNHM-UHFFFAOYSA-N
Molecular Formula	C6H14N2O2S

Methanesulfonamide, 98%

CAS: 3144-09-0 Molecular Formula: CH5NO2S Molecular Weight (g/mol): 95.12 MDL Number: MFCD00007940 InChI Key: HNQIVZYLYMDVSB-UHFFFAOYSA-N Synonym: methylsulfonamide,methane sulfonamide,methanesulphonamide,methansulfonamid,methyl sulfonamide,aminosulfane dioxide,methyl sulfonylamine,ch3so2nh2,mesylamine,methansulfonamide PubChem CID: 72879 IUPAC Name: methanesulfonamide SMILES: CS(N)(=O)=O

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Specifications

PubChem CID	72879
CAS	3144-09-0
Molecular Weight (g/mol)	95.12
MDL Number	MFCD00007940
SMILES	CS(N)(=O)=O
Synonym	methylsulfonamide,methane sulfonamide,methanesulphonamide,methansulfonamid,methyl sulfonamide,aminosulfane dioxide,methyl sulfonylamine,ch3so2nh2,mesylamine,methansulfonamide
IUPAC Name	methanesulfonamide
InChI Key	HNQIVZYLYMDVSB-UHFFFAOYSA-N
Molecular Formula	CH5NO2S

2,3-Dimercapto-1-propanesulfonic acid sodium salt monohydrate, 95%

CAS: 207233-91-8 Molecular Formula: C3H7O3S3 Molecular Weight (g/mol): 187.27 MDL Number: MFCD00149543 InChI Key: JLVSRWOIZZXQAD-GSVOUGTGSA-M Synonym: sodium 2,3-dimercaptopropanesulfonate monohydrate,unithiol,dl-2,3-dimercapto-1-propanesulfonic acid sodium salt monohydrate,sodium 2,3-dimercaptopropane-1-sulfonate hydrate,2,3-dimercapto-1-propanesulfonic acid sodium salt monohydrate,sodium 2,3-dimercaptopropanesulfonate hydrate,dmps,sodium 2,3-disulfanylpropane-1-sulfonate hydrate,unitiol monohydrate PubChem CID: 23676755 SMILES: [O-]S(=O)(=O)C[C@H](S)CS

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Specifications

PubChem CID	23676755
CAS	207233-91-8
Molecular Weight (g/mol)	187.27
MDL Number	MFCD00149543
SMILES	[O-]S(=O)(=O)C[C@H](S)CS
Synonym	sodium 2,3-dimercaptopropanesulfonate monohydrate,unithiol,dl-2,3-dimercapto-1-propanesulfonic acid sodium salt monohydrate,sodium 2,3-dimercaptopropane-1-sulfonate hydrate,2,3-dimercapto-1-propanesulfonic acid sodium salt monohydrate,sodium 2,3-dimercaptopropanesulfonate hydrate,dmps,sodium 2,3-disulfanylpropane-1-sulfonate hydrate,unitiol monohydrate
InChI Key	JLVSRWOIZZXQAD-GSVOUGTGSA-M
Molecular Formula	C3H7O3S3

Propargyl p-toluenesulfonate, 97%

CAS: 6165-76-0 Molecular Formula: C10H10O3S Molecular Weight (g/mol): 210.247 MDL Number: MFCD00078365 InChI Key: LMBVCSFXFFROTA-UHFFFAOYSA-N Synonym: propargyl p-toluenesulfonate,propargyl tosylate,prop-2-yn-1-yl 4-methylbenzenesulfonate,p-toluenesulfonic acid, 2-propynyl ester,2-propyn-1-ol, 4-methylbenzenesulfonate,ccris 9146,p-toluenesulfonic acid propargyl ester,propargylp-toluenesulfonate,propargyl p-toluene sulfonate,acmc-209mv7 PubChem CID: 22547 IUPAC Name: prop-2-ynyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC#C

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Specifications

PubChem CID	22547
CAS	6165-76-0
Molecular Weight (g/mol)	210.247
MDL Number	MFCD00078365
SMILES	CC1=CC=C(C=C1)S(=O)(=O)OCC#C
Synonym	propargyl p-toluenesulfonate,propargyl tosylate,prop-2-yn-1-yl 4-methylbenzenesulfonate,p-toluenesulfonic acid, 2-propynyl ester,2-propyn-1-ol, 4-methylbenzenesulfonate,ccris 9146,p-toluenesulfonic acid propargyl ester,propargylp-toluenesulfonate,propargyl p-toluene sulfonate,acmc-209mv7
IUPAC Name	prop-2-ynyl 4-methylbenzenesulfonate
InChI Key	LMBVCSFXFFROTA-UHFFFAOYSA-N
Molecular Formula	C10H10O3S

Sodium vinylsulfonate, tech. ca 25% aq. soln.

CAS: 3039-83-6 Molecular Formula: C2H3NaO3S Molecular Weight (g/mol): 130.09 MDL Number: MFCD00007520 InChI Key: BWYYYTVSBPRQCN-UHFFFAOYSA-M Synonym: sodium ethenesulfonate,sodium vinylsulfonate,ethenesulfonic acid, sodium salt,sodium ethylenesulfonate,sodium vinyl sulfonate,sodium ethylenesulphonate,sodium apolate,unii-f7k3l38z7b,sodium ethenesulfonate in h2o,lyapolate sodium usan PubChem CID: 3270262 IUPAC Name: sodium;ethenesulfonate SMILES: [Na+].[O-]S(=O)(=O)C=C

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Specifications

PubChem CID	3270262
CAS	3039-83-6
Molecular Weight (g/mol)	130.09
MDL Number	MFCD00007520
SMILES	[Na+].[O-]S(=O)(=O)C=C
Synonym	sodium ethenesulfonate,sodium vinylsulfonate,ethenesulfonic acid, sodium salt,sodium ethylenesulfonate,sodium vinyl sulfonate,sodium ethylenesulphonate,sodium apolate,unii-f7k3l38z7b,sodium ethenesulfonate in h2o,lyapolate sodium usan
IUPAC Name	sodium;ethenesulfonate
InChI Key	BWYYYTVSBPRQCN-UHFFFAOYSA-M
Molecular Formula	C2H3NaO3S

1-Butanesulfonic acid, sodium salt, 99+%, Ion pair chromatography, anhydrous

CAS: 2386-54-1 Molecular Formula: C4H9NaO3S Molecular Weight (g/mol): 160.16 MDL Number: MFCD00007540 InChI Key: XQCHMGAOAWZUPI-UHFFFAOYSA-M Synonym: sodium 1-butanesulfonate,sodium butane-1-sulfonate,1-butanesulfonic acid sodium salt,sodium butylsulfonate,1-butanesulfonic acid, sodium salt,sodium butane-1-sulphonate,sodium butanesulfonate,ipc-alks-4,1-butanesulfonic acid, sodium salt 1:1,acmc-1cdot PubChem CID: 4096517 IUPAC Name: sodium;butane-1-sulfonate SMILES: [Na+].CCCCS([O-])(=O)=O

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Specifications

PubChem CID	4096517
CAS	2386-54-1
Molecular Weight (g/mol)	160.16
MDL Number	MFCD00007540
SMILES	[Na+].CCCCS([O-])(=O)=O
Synonym	sodium 1-butanesulfonate,sodium butane-1-sulfonate,1-butanesulfonic acid sodium salt,sodium butylsulfonate,1-butanesulfonic acid, sodium salt,sodium butane-1-sulphonate,sodium butanesulfonate,ipc-alks-4,1-butanesulfonic acid, sodium salt 1:1,acmc-1cdot
IUPAC Name	sodium;butane-1-sulfonate
InChI Key	XQCHMGAOAWZUPI-UHFFFAOYSA-M
Molecular Formula	C4H9NaO3S

Sodium 3-chloro-2-hydroxypropanesulfonate hemihydrate, 98%

CAS: 143218-48-8 Molecular Formula: C3H8ClNaO5S Molecular Weight (g/mol): 214.592 MDL Number: MFCD00149699 InChI Key: ZPFGAXXLEFTBEU-UHFFFAOYSA-M Synonym: sodium 3-chloro-2-hydroxypropanesulphonate hemihydrate,sodium 3-chloro-2-hydroxypropanesulfonate hydrate,3-chloro-2-hydroxy-1-propanesulfonic acid sodium salt hydrate,sodium 3-chloro-2-hydroxypropane-1-sulfonate hydrate,c3h6clnao4s.0.5h2o,sodium 3-chloro-2-hydroxypropane-1-sulfonate-water 1/1/1,3-chloro-2-hydroxypropanesulfonic acid sodium salt hydrate PubChem CID: 23665651 IUPAC Name: sodium;3-chloro-2-hydroxypropane-1-sulfonate;hydrate SMILES: C(C(CCl)O)S(=O)(=O)[O-].O.[Na+]

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Specifications

PubChem CID	23665651
CAS	143218-48-8
Molecular Weight (g/mol)	214.592
MDL Number	MFCD00149699
SMILES	C(C(CCl)O)S(=O)(=O)[O-].O.[Na+]
Synonym	sodium 3-chloro-2-hydroxypropanesulphonate hemihydrate,sodium 3-chloro-2-hydroxypropanesulfonate hydrate,3-chloro-2-hydroxy-1-propanesulfonic acid sodium salt hydrate,sodium 3-chloro-2-hydroxypropane-1-sulfonate hydrate,c3h6clnao4s.0.5h2o,sodium 3-chloro-2-hydroxypropane-1-sulfonate-water 1/1/1,3-chloro-2-hydroxypropanesulfonic acid sodium salt hydrate
IUPAC Name	sodium;3-chloro-2-hydroxypropane-1-sulfonate;hydrate
InChI Key	ZPFGAXXLEFTBEU-UHFFFAOYSA-M
Molecular Formula	C3H8ClNaO5S

Trifluoromethanesulfonic anhydride, 98+%

CAS: 358-23-6 MDL Number: MFCD00000408 InChI Key: WJKHJLXJJJATHN-UHFFFAOYSA-N Synonym: trifluoromethanesulfonic anhydride,triflic anhydride,trifluoromethanesulphonic anhydride,trifluoromethanesulfonic acid anhydride,methanesulfonic acid, trifluoro-, anhydride,trifluoromethanesulphonic acid anhydride,unii-8w034lhg1u,tf2o,trifluoromethane sulfonyl trifluoromethanesulfonate,trifluoromethane sulfonic anhydride PubChem CID: 67749 ChEBI: CHEBI:48509 IUPAC Name: trifluoromethylsulfonyl trifluoromethanesulfonate SMILES: C(F)(F)(F)S(=O)(=O)OS(=O)(=O)C(F)(F)F

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Specifications

PubChem CID	67749
CAS	358-23-6
ChEBI	CHEBI:48509
MDL Number	MFCD00000408
SMILES	C(F)(F)(F)S(=O)(=O)OS(=O)(=O)C(F)(F)F
Synonym	trifluoromethanesulfonic anhydride,triflic anhydride,trifluoromethanesulphonic anhydride,trifluoromethanesulfonic acid anhydride,methanesulfonic acid, trifluoro-, anhydride,trifluoromethanesulphonic acid anhydride,unii-8w034lhg1u,tf2o,trifluoromethane sulfonyl trifluoromethanesulfonate,trifluoromethane sulfonic anhydride
IUPAC Name	trifluoromethylsulfonyl trifluoromethanesulfonate
InChI Key	WJKHJLXJJJATHN-UHFFFAOYSA-N

Propyl p-toluenesulfonate, 98+%

CAS: 599-91-7 Molecular Formula: C₁₀H₁₄O₃S Molecular Weight (g/mol): 214.28 MDL Number: MFCD00059244 InChI Key: JTTWNTXHFYNETH-UHFFFAOYSA-N Synonym: propyl p-toluenesulfonate,propyl tosylate,benzenesulfonic acid, 4-methyl-, propyl ester,p-toluenesulfonic acid, propyl ester,propyl toluene-4-sulphonate,ccris 9150,p-toluenesulfonic acid n-propyl ester,p-toluenesulfonic acid propyl ester,propanol tosylate,acmc-209mha PubChem CID: 69035 IUPAC Name: propyl 4-methylbenzenesulfonate SMILES: CCCOS(=O)(=O)C1=CC=C(C=C1)C

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Specifications

PubChem CID	69035
CAS	599-91-7
Molecular Weight (g/mol)	214.28
MDL Number	MFCD00059244
SMILES	CCCOS(=O)(=O)C1=CC=C(C=C1)C
Synonym	propyl p-toluenesulfonate,propyl tosylate,benzenesulfonic acid, 4-methyl-, propyl ester,p-toluenesulfonic acid, propyl ester,propyl toluene-4-sulphonate,ccris 9150,p-toluenesulfonic acid n-propyl ester,p-toluenesulfonic acid propyl ester,propanol tosylate,acmc-209mha
IUPAC Name	propyl 4-methylbenzenesulfonate
InChI Key	JTTWNTXHFYNETH-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₄O₃S

1-Octanesulfonic acid, sodium salt, 99+%, Ion pair chromatography, anhydrous

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

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Specifications

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

Organic sulfonic acids and derivatives

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