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-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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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

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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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Specifications

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

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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

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Specifications

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

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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

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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

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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

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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

Tricaine 97.0+%, TCI America™

CAS: 886-86-2 Molecular Formula: C10H15NO5S Molecular Weight (g/mol): 261.292 MDL Number: MFCD00013176 InChI Key: FQZJYWMRQDKBQN-UHFFFAOYSA-N Synonym: ethyl 3-aminobenzoate methanesulfonate,tricaine,tricaine methanesulfonate,finquel,metacaine,tricaine mesylate,3-aminobenzoic acid ethyl ester methanesulfonate,ethyl m-aminobenzoate methanesulfonate,ethyl 3-aminobenzoate methanesulfonic acid salt,3-aminobenzoic acid ethyl ester methanesulfonate salt PubChem CID: 261501 IUPAC Name: ethyl 3-aminobenzoate;methanesulfonic acid SMILES: CCOC(=O)C1=CC(=CC=C1)N.CS(=O)(=O)O

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Specifications

PubChem CID	261501
CAS	886-86-2
Molecular Weight (g/mol)	261.292
MDL Number	MFCD00013176
SMILES	CCOC(=O)C1=CC(=CC=C1)N.CS(=O)(=O)O
Synonym	ethyl 3-aminobenzoate methanesulfonate,tricaine,tricaine methanesulfonate,finquel,metacaine,tricaine mesylate,3-aminobenzoic acid ethyl ester methanesulfonate,ethyl m-aminobenzoate methanesulfonate,ethyl 3-aminobenzoate methanesulfonic acid salt,3-aminobenzoic acid ethyl ester methanesulfonate salt
IUPAC Name	ethyl 3-aminobenzoate;methanesulfonic acid
InChI Key	FQZJYWMRQDKBQN-UHFFFAOYSA-N
Molecular Formula	C10H15NO5S

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TAPS, 99%

CAS: 29915-38-6 Molecular Formula: C7H17NO6S Molecular Weight (g/mol): 243.27 MDL Number: MFCD00007538 InChI Key: YNLCVAQJIKOXER-UHFFFAOYSA-N Synonym: taps,3-1,3-dihydroxy-2-hydroxymethyl propan-2-yl amino propane-1-sulfonic acid,unii-y5dc3in066,n-tris hydroxymethyl methyl-3-aminopropanesulfonic acid,2-hydroxy-1,1-bis hydroxymethyl ethyl amino-1-propanesulfonic acid,3-2-hydroxy-1,1-bis hydroxymethyl ethyl amino-1-propanesulfonic acid,taps buffer,1-propanesulfonic acid, 3-2-hydroxy-1,1-bis hydroxymethyl ethyl amino PubChem CID: 121591 IUPAC Name: 3-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]propane-1-sulfonic acid SMILES: OCC(CO)(CO)NCCCS(O)(=O)=O

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Specifications

PubChem CID	121591
CAS	29915-38-6
Molecular Weight (g/mol)	243.27
MDL Number	MFCD00007538
SMILES	OCC(CO)(CO)NCCCS(O)(=O)=O
Synonym	taps,3-1,3-dihydroxy-2-hydroxymethyl propan-2-yl amino propane-1-sulfonic acid,unii-y5dc3in066,n-tris hydroxymethyl methyl-3-aminopropanesulfonic acid,2-hydroxy-1,1-bis hydroxymethyl ethyl amino-1-propanesulfonic acid,3-2-hydroxy-1,1-bis hydroxymethyl ethyl amino-1-propanesulfonic acid,taps buffer,1-propanesulfonic acid, 3-2-hydroxy-1,1-bis hydroxymethyl ethyl amino
IUPAC Name	3-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]propane-1-sulfonic acid
InChI Key	YNLCVAQJIKOXER-UHFFFAOYSA-N
Molecular Formula	C7H17NO6S

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Isethionic acid sodium salt, 98%

CAS: 1562-00-1 Molecular Formula: C2H5NaO4S Molecular Weight (g/mol): 148.108 MDL Number: MFCD00007534 InChI Key: LADXKQRVAFSPTR-UHFFFAOYSA-M Synonym: sodium 2-hydroxyethanesulfonate,sodium isethionate,isethionic acid sodium salt,2-hydroxyethanesulfonic acid sodium salt,sodium hydroxyethylsulfonate,ethanesulfonic acid, 2-hydroxy-, monosodium salt,sodium 2-hydroxyethylsulfonate,sodium 2-hydroxyethanesulphonate,sodium beta-hydroxyethanesulfonate,sodium 1-hydroxy-2-ethanesulfonate PubChem CID: 517063 IUPAC Name: sodium;2-hydroxyethanesulfonate SMILES: C(CS(=O)(=O)[O-])O.[Na+]

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Specifications

PubChem CID	517063
CAS	1562-00-1
Molecular Weight (g/mol)	148.108
MDL Number	MFCD00007534
SMILES	C(CS(=O)(=O)[O-])O.[Na+]
Synonym	sodium 2-hydroxyethanesulfonate,sodium isethionate,isethionic acid sodium salt,2-hydroxyethanesulfonic acid sodium salt,sodium hydroxyethylsulfonate,ethanesulfonic acid, 2-hydroxy-, monosodium salt,sodium 2-hydroxyethylsulfonate,sodium 2-hydroxyethanesulphonate,sodium beta-hydroxyethanesulfonate,sodium 1-hydroxy-2-ethanesulfonate
IUPAC Name	sodium;2-hydroxyethanesulfonate
InChI Key	LADXKQRVAFSPTR-UHFFFAOYSA-M
Molecular Formula	C2H5NaO4S

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3-(N,N-Dimethylmyristylammonio)propanesulfonate, 97%

CAS: 14933-09-6 Molecular Formula: C₁₉H₄₁NO₃S Molecular Weight (g/mol): 363.61 MDL Number: MFCD00036910 InChI Key: BHATUINFZWUDIX-UHFFFAOYSA-N Synonym: myristyl sulfobetaine,zwittergent 3-14,n-tetradecyl-n,n-dimethyl-3-ammonio-1-propanesulfonate,3-dimethyl tetradecyl ammonio propane-1-sulfonate,3-n,n-dimethylmyristylammonio propanesulfonate,dimethyl 3-sulphonatopropyl tetradecylammonium,zwittergent™ 3-14 detergent,3-myristyldimethylammonio propanesulfonate,3-n,n-dimethyltetradecylammonio propanesulfonate PubChem CID: 84705 ChEBI: CHEBI:10129 IUPAC Name: 3-[dimethyl(tetradecyl)azaniumyl]propane-1-sulfonate SMILES: CCCCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]

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Specifications

PubChem CID	84705
CAS	14933-09-6
Molecular Weight (g/mol)	363.61
ChEBI	CHEBI:10129
MDL Number	MFCD00036910
SMILES	CCCCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]
Synonym	myristyl sulfobetaine,zwittergent 3-14,n-tetradecyl-n,n-dimethyl-3-ammonio-1-propanesulfonate,3-dimethyl tetradecyl ammonio propane-1-sulfonate,3-n,n-dimethylmyristylammonio propanesulfonate,dimethyl 3-sulphonatopropyl tetradecylammonium,zwittergent™ 3-14 detergent,3-myristyldimethylammonio propanesulfonate,3-n,n-dimethyltetradecylammonio propanesulfonate
IUPAC Name	3-[dimethyl(tetradecyl)azaniumyl]propane-1-sulfonate
InChI Key	BHATUINFZWUDIX-UHFFFAOYSA-N
Molecular Formula	C₁₉H₄₁NO₃S

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3-Nitrobenzenesulfonic acid, sodium salt, 97%

CAS: 127-68-4 Molecular Formula: C₆H₄NNaO₅S Molecular Weight (g/mol): 225.15 MDL Number: MFCD00007490 InChI Key: LJRGBERXYNQPJI-UHFFFAOYSA-M Synonym: sodium 3-nitrobenzenesulfonate,3-nitrobenzenesulfonic acid sodium salt,sodium 3-nitrobenzenesulphonate,sodium m-nitrobenzenesulfonate,nitrol s,tiskan czech,ludigol,ludigol f,60,benzenesulfonic acid, 3-nitro-, sodium salt,unii-1f11sxj4c6 PubChem CID: 31389 IUPAC Name: sodium;3-nitrobenzenesulfonate SMILES: C1=CC(=CC(=C1)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]

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Specifications

PubChem CID	31389
CAS	127-68-4
Molecular Weight (g/mol)	225.15
MDL Number	MFCD00007490
SMILES	C1=CC(=CC(=C1)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]
Synonym	sodium 3-nitrobenzenesulfonate,3-nitrobenzenesulfonic acid sodium salt,sodium 3-nitrobenzenesulphonate,sodium m-nitrobenzenesulfonate,nitrol s,tiskan czech,ludigol,ludigol f,60,benzenesulfonic acid, 3-nitro-, sodium salt,unii-1f11sxj4c6
IUPAC Name	sodium;3-nitrobenzenesulfonate
InChI Key	LJRGBERXYNQPJI-UHFFFAOYSA-M
Molecular Formula	C₆H₄NNaO₅S

Sodium methanesulfonate, 98%

CAS: 2386-57-4 Molecular Formula: CH3NaO3S Molecular Weight (g/mol): 118.082 MDL Number: MFCD00064389 InChI Key: KKVTYAVXTDIPAP-UHFFFAOYSA-M Synonym: sodium methanesulfonate,methanesulfonic acid sodium salt,methanesulfonic acid, sodium salt,sodium methanesulphonate,sodium mesylate,methylsulfonic acid sodium salt,75-75-2 parent,sodium methyl sulfonate,methanesulfonic acid, sodium salt 1:1,sodium methylsulfonate PubChem CID: 638112 IUPAC Name: sodium;methanesulfonate SMILES: CS(=O)(=O)[O-].[Na+]

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Specifications

PubChem CID	638112
CAS	2386-57-4
Molecular Weight (g/mol)	118.082
MDL Number	MFCD00064389
SMILES	CS(=O)(=O)[O-].[Na+]
Synonym	sodium methanesulfonate,methanesulfonic acid sodium salt,methanesulfonic acid, sodium salt,sodium methanesulphonate,sodium mesylate,methylsulfonic acid sodium salt,75-75-2 parent,sodium methyl sulfonate,methanesulfonic acid, sodium salt 1:1,sodium methylsulfonate
IUPAC Name	sodium;methanesulfonate
InChI Key	KKVTYAVXTDIPAP-UHFFFAOYSA-M
Molecular Formula	CH3NaO3S

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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

(-)-1,2-Bis[(2R,5R)-2,5-diethylphospholano]benzene(1,5-cyclooctadiene)rhodium(I) trifluoromethanesulfonate, 97%

CAS: 136705-77-6 Molecular Formula: C31H48F3O3P2RhS Molecular Weight (g/mol): 722.63 MDL Number: MFCD00269860 InChI Key: XGPXBCKGQLCHDW-UHFFFAOYNA-M Synonym: --1,2-bis 2r,5r-2,5-diethylphospholano benzene cyclooctadiene rhodium i trifluoromethanesulfonate,--1,2-bis 2r,5r-2,5-diethylphospholono benzene cycloactadiene rhodium i trifluoromethanesulfonate,1z,5z-cycloocta-1,5-diene; 2r,5r-1-2-2r,5r-2,5-diethylphospholan-1-yl phenyl-2,5-diethylphospholane; rhodium; trifluoromethanesulfonate PubChem CID: 5702639 IUPAC Name: 1-[2-(2,5-diethylphospholan-1-yl)phenyl]-2,5-diethylphospholane cycloocta-1,5-diene rhodium trifluoromethanesulfonate SMILES: [Rh].[O-]S(=O)(=O)C(F)(F)F.C1CC=CCCC=C1.CCC1CCC(CC)P1C1=CC=CC=C1P1C(CC)CCC1CC

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Specifications

PubChem CID	5702639
CAS	136705-77-6
Molecular Weight (g/mol)	722.63
MDL Number	MFCD00269860
SMILES	[Rh].[O-]S(=O)(=O)C(F)(F)F.C1CC=CCCC=C1.CCC1CCC(CC)P1C1=CC=CC=C1P1C(CC)CCC1CC
Synonym	--1,2-bis 2r,5r-2,5-diethylphospholano benzene cyclooctadiene rhodium i trifluoromethanesulfonate,--1,2-bis 2r,5r-2,5-diethylphospholono benzene cycloactadiene rhodium i trifluoromethanesulfonate,1z,5z-cycloocta-1,5-diene; 2r,5r-1-2-2r,5r-2,5-diethylphospholan-1-yl phenyl-2,5-diethylphospholane; rhodium; trifluoromethanesulfonate
IUPAC Name	1-[2-(2,5-diethylphospholan-1-yl)phenyl]-2,5-diethylphospholane cycloocta-1,5-diene rhodium trifluoromethanesulfonate
InChI Key	XGPXBCKGQLCHDW-UHFFFAOYNA-M
Molecular Formula	C31H48F3O3P2RhS

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Pentaethylene glycol di-p-toluenesulfonate, 90+%

CAS: 41024-91-3 Molecular Formula: C24H34O10S2 Molecular Weight (g/mol): 546.646 MDL Number: MFCD00012204 InChI Key: BUHGDYPBQWWWQS-UHFFFAOYSA-N Synonym: 3,6,9,12-tetraoxatetradecane-1,14-diyl bis 4-methylbenzenesulfonate,pentaethylene glycol ditosylate,pentaethylene glycol di-p-toluenesulfonate,pentaethylene glycol di p-toluenesulfonate,tos-peg6-tos,3,6,9,12-tetraoxatetradecane-1,14-diol, bis 4-methylbenzenesulfonate,pentaethylene glycol d p-toluenesulfonate,penta ethylene glycol di-p-toluenesulfonate,3,6,9,12-tetraoxatetradecane-1,14-diyl ditosylate PubChem CID: 361968 IUPAC Name: 2-[2-[2-[2-[2-(4-methylphenyl)sulfonyloxyethoxy]ethoxy]ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOCCOCCOCCOS(=O)(=O)C2=CC=C(C=C2)C

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Specifications

PubChem CID	361968
CAS	41024-91-3
Molecular Weight (g/mol)	546.646
MDL Number	MFCD00012204
SMILES	CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOCCOCCOCCOS(=O)(=O)C2=CC=C(C=C2)C
Synonym	3,6,9,12-tetraoxatetradecane-1,14-diyl bis 4-methylbenzenesulfonate,pentaethylene glycol ditosylate,pentaethylene glycol di-p-toluenesulfonate,pentaethylene glycol di p-toluenesulfonate,tos-peg6-tos,3,6,9,12-tetraoxatetradecane-1,14-diol, bis 4-methylbenzenesulfonate,pentaethylene glycol d p-toluenesulfonate,penta ethylene glycol di-p-toluenesulfonate,3,6,9,12-tetraoxatetradecane-1,14-diyl ditosylate
IUPAC Name	2-[2-[2-[2-[2-(4-methylphenyl)sulfonyloxyethoxy]ethoxy]ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate
InChI Key	BUHGDYPBQWWWQS-UHFFFAOYSA-N
Molecular Formula	C24H34O10S2

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tert-Butyldimethylsilyl trifluoromethanesulfonate, 98%

CAS: 69739-34-0 Molecular Formula: C7H15F3O3SSi Molecular Weight (g/mol): 264.33 MDL Number: MFCD00000405 InChI Key: WLLIXJBWWFGEHT-UHFFFAOYSA-N Synonym: tert-butyldimethylsilyl trifluoromethanesulfonate,trifluoromethanesulfonic acid tert-butyldimethylsilyl ester,tbdms triflate,t-butyldimethylsilyl triflate,tert-butyldimethylsilyl trifluoromethanesulphonate,tbdms-otf,tert-butyldimethylsilyl triflate,silane tbm2 triflate,t-butyldimethylsilyltrifluoromethanesulfonate,t-butylmethylsilyl triflate PubChem CID: 123564 IUPAC Name: [tert-butyl(dimethyl)silyl] trifluoromethanesulfonate SMILES: CC(C)(C)[Si](C)(C)OS(=O)(=O)C(F)(F)F

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Specifications

PubChem CID	123564
CAS	69739-34-0
Molecular Weight (g/mol)	264.33
MDL Number	MFCD00000405
SMILES	CC(C)(C)[Si](C)(C)OS(=O)(=O)C(F)(F)F
Synonym	tert-butyldimethylsilyl trifluoromethanesulfonate,trifluoromethanesulfonic acid tert-butyldimethylsilyl ester,tbdms triflate,t-butyldimethylsilyl triflate,tert-butyldimethylsilyl trifluoromethanesulphonate,tbdms-otf,tert-butyldimethylsilyl triflate,silane tbm2 triflate,t-butyldimethylsilyltrifluoromethanesulfonate,t-butylmethylsilyl triflate
IUPAC Name	[tert-butyl(dimethyl)silyl] trifluoromethanesulfonate
InChI Key	WLLIXJBWWFGEHT-UHFFFAOYSA-N
Molecular Formula	C7H15F3O3SSi

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