Organic acids and derivatives
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Sodium dichloroacetate, 96%
CAS: 2156-56-1 Molecular Formula: C2HCl2NaO2 Molecular Weight (g/mol): 150.92 MDL Number: MFCD00070489 InChI Key: LUPNKHXLFSSUGS-UHFFFAOYSA-M Synonym: sodium dichloroacetate,sodium 2,2-dichloroacetate,dichloroacetic acid sodium salt,acetic acid, dichloro-, sodium salt,ceresine,dichloroacetate sodium,dichloroctan sodny czech,sodium dichloroacetate usan,ccris 7697,dichloroacetic acid, sodium salt PubChem CID: 517326 IUPAC Name: sodium;2,2-dichloroacetate SMILES: [Na+].[O-]C(=O)C(Cl)Cl
| PubChem CID | 517326 |
|---|---|
| CAS | 2156-56-1 |
| Molecular Weight (g/mol) | 150.92 |
| MDL Number | MFCD00070489 |
| SMILES | [Na+].[O-]C(=O)C(Cl)Cl |
| Synonym | sodium dichloroacetate,sodium 2,2-dichloroacetate,dichloroacetic acid sodium salt,acetic acid, dichloro-, sodium salt,ceresine,dichloroacetate sodium,dichloroctan sodny czech,sodium dichloroacetate usan,ccris 7697,dichloroacetic acid, sodium salt |
| IUPAC Name | sodium;2,2-dichloroacetate |
| InChI Key | LUPNKHXLFSSUGS-UHFFFAOYSA-M |
| Molecular Formula | C2HCl2NaO2 |
Bromoacetic anhydride, 95%
CAS: 13094-51-4 Molecular Formula: C4H4Br2O3 Molecular Weight (g/mol): 259.87 MDL Number: MFCD00045041 InChI Key: FUKOTTQGWQVMQB-UHFFFAOYSA-N Synonym: bromoacetic anhydride,2-bromoacetic anhydride,acetic acid, 2-bromo-,1,1'-anhydride,2-bromoacetyl 2-bromoacetate,bromoaceticanhydride,acetic acid, bromo-, anhydride PubChem CID: 4259817 IUPAC Name: (2-bromoacetyl) 2-bromoacetate SMILES: C(C(=O)OC(=O)CBr)Br
| PubChem CID | 4259817 |
|---|---|
| CAS | 13094-51-4 |
| Molecular Weight (g/mol) | 259.87 |
| MDL Number | MFCD00045041 |
| SMILES | C(C(=O)OC(=O)CBr)Br |
| Synonym | bromoacetic anhydride,2-bromoacetic anhydride,acetic acid, 2-bromo-,1,1'-anhydride,2-bromoacetyl 2-bromoacetate,bromoaceticanhydride,acetic acid, bromo-, anhydride |
| IUPAC Name | (2-bromoacetyl) 2-bromoacetate |
| InChI Key | FUKOTTQGWQVMQB-UHFFFAOYSA-N |
| Molecular Formula | C4H4Br2O3 |
Ethyl oxalyl chloride, 98%
CAS: 4755-77-5 Molecular Formula: C4H5ClO3 Molecular Weight (g/mol): 136.531 MDL Number: MFCD00000706 InChI Key: OWZFULPEVHKEKS-UHFFFAOYSA-N Synonym: ethyl chlorooxoacetate,ethyl oxalyl chloride,ethyl chloroglyoxylate,ethoxalyl chloride,ethyl oxalyl monochloride,acetic acid, chlorooxo-, ethyl ester,oxalic acid monoethyl ester chloride,monoethyl oxaloyl chloride,oxalyl chloride, ethyl ester,ethyl chlorocarbonyl formate PubChem CID: 20884 IUPAC Name: ethyl 2-chloro-2-oxoacetate SMILES: CCOC(=O)C(=O)Cl
| PubChem CID | 20884 |
|---|---|
| CAS | 4755-77-5 |
| Molecular Weight (g/mol) | 136.531 |
| MDL Number | MFCD00000706 |
| SMILES | CCOC(=O)C(=O)Cl |
| Synonym | ethyl chlorooxoacetate,ethyl oxalyl chloride,ethyl chloroglyoxylate,ethoxalyl chloride,ethyl oxalyl monochloride,acetic acid, chlorooxo-, ethyl ester,oxalic acid monoethyl ester chloride,monoethyl oxaloyl chloride,oxalyl chloride, ethyl ester,ethyl chlorocarbonyl formate |
| IUPAC Name | ethyl 2-chloro-2-oxoacetate |
| InChI Key | OWZFULPEVHKEKS-UHFFFAOYSA-N |
| Molecular Formula | C4H5ClO3 |
1,3-Bis(hydroxymethyl)urea, tech. 90%
CAS: 140-95-4 Molecular Formula: C3H8N2O3 Molecular Weight (g/mol): 120.11 MDL Number: MFCD00014414 InChI Key: QUBQYFYWUJJAAK-UHFFFAOYSA-N Synonym: 1,3-bis hydroxymethyl urea,dimethylolurea,oxymethurea,n,n'-dimethylolurea,methural,carbamol,caurite,metural,urofix,protesine dmu PubChem CID: 8827 IUPAC Name: 1,3-bis(hydroxymethyl)urea SMILES: OCNC(=O)NCO
| PubChem CID | 8827 |
|---|---|
| CAS | 140-95-4 |
| Molecular Weight (g/mol) | 120.11 |
| MDL Number | MFCD00014414 |
| SMILES | OCNC(=O)NCO |
| Synonym | 1,3-bis hydroxymethyl urea,dimethylolurea,oxymethurea,n,n'-dimethylolurea,methural,carbamol,caurite,metural,urofix,protesine dmu |
| IUPAC Name | 1,3-bis(hydroxymethyl)urea |
| InChI Key | QUBQYFYWUJJAAK-UHFFFAOYSA-N |
| Molecular Formula | C3H8N2O3 |
Urea, BAKER ANALYZED™ A.C.S. Reagent, J.T. Baker™
CAS: 57-13-6 Molecular Formula: CH4N2O Molecular Weight (g/mol): 60.056 InChI Key: XSQUKJJJFZCRTK-UHFFFAOYSA-N Synonym: carbamide,isourea,carbonyldiamide,ureophil,carbonyldiamine,carbamimidic acid,pseudourea,ureaphil,urevert,alphadrate PubChem CID: 1176 ChEBI: CHEBI:48376 IUPAC Name: urea SMILES: C(=O)(N)N
| PubChem CID | 1176 |
|---|---|
| CAS | 57-13-6 |
| Molecular Weight (g/mol) | 60.056 |
| ChEBI | CHEBI:48376 |
| SMILES | C(=O)(N)N |
| Synonym | carbamide,isourea,carbonyldiamide,ureophil,carbonyldiamine,carbamimidic acid,pseudourea,ureaphil,urevert,alphadrate |
| IUPAC Name | urea |
| InChI Key | XSQUKJJJFZCRTK-UHFFFAOYSA-N |
| Molecular Formula | CH4N2O |
Acetohydrazide, Spectrum™ Chemical
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CAS: 1068-57-1
| CAS | 1068-57-1 |
|---|
| CAS | 108-73-6 |
|---|---|
| Molecular Weight (g/mol) | 126.11 g/mol |
Methanesulfonic acid, 98%
CAS: 75-75-2 Molecular Formula: CH4O3S Molecular Weight (g/mol): 96.1 InChI Key: AFVFQIVMOAPDHO-UHFFFAOYSA-N Synonym: methylsulfonic acid,methanesulphonic acid,methanesulfonicacid,kyselina methansulfonova,methansulfonsaeure,ccris 2783,kyselina methansulfonova czech,ch3so3h,methane sulfonic acid,sulfomethane PubChem CID: 6395 ChEBI: CHEBI:27376 IUPAC Name: methanesulfonic acid SMILES: CS(=O)(=O)O
| PubChem CID | 6395 |
|---|---|
| CAS | 75-75-2 |
| Molecular Weight (g/mol) | 96.1 |
| ChEBI | CHEBI:27376 |
| SMILES | CS(=O)(=O)O |
| Synonym | methylsulfonic acid,methanesulphonic acid,methanesulfonicacid,kyselina methansulfonova,methansulfonsaeure,ccris 2783,kyselina methansulfonova czech,ch3so3h,methane sulfonic acid,sulfomethane |
| IUPAC Name | methanesulfonic acid |
| InChI Key | AFVFQIVMOAPDHO-UHFFFAOYSA-N |
| Molecular Formula | CH4O3S |
Sodium 1-pentanesulfonate, 99% (dry wt.), water <1.5%
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 |
3-(Di-tert-butylphosphonium)propane sulfonate, 97%
CAS: 1055888-89-5 Molecular Formula: C11H25O3PS Molecular Weight (g/mol): 268.352 MDL Number: MFCD12546062 InChI Key: JPNPRWMRUCIEMN-UHFFFAOYSA-N Synonym: 3-di-t-butylphosphonium propane sulfonate,3-di-tert-butylphosphino propane-1-sulfonic acid,dtbpps,di-t-butyl 3-sulfonatopropyl phosphine,3-di-tert-butylphosphonium propane sulfonate,3-di-tert-butylphosphanyl propane-1-sulfonic acid PubChem CID: 24949188 IUPAC Name: 3-ditert-butylphosphanylpropane-1-sulfonic acid SMILES: CC(C)(C)P(CCCS(=O)(=O)O)C(C)(C)C
| PubChem CID | 24949188 |
|---|---|
| CAS | 1055888-89-5 |
| Molecular Weight (g/mol) | 268.352 |
| MDL Number | MFCD12546062 |
| SMILES | CC(C)(C)P(CCCS(=O)(=O)O)C(C)(C)C |
| Synonym | 3-di-t-butylphosphonium propane sulfonate,3-di-tert-butylphosphino propane-1-sulfonic acid,dtbpps,di-t-butyl 3-sulfonatopropyl phosphine,3-di-tert-butylphosphonium propane sulfonate,3-di-tert-butylphosphanyl propane-1-sulfonic acid |
| IUPAC Name | 3-ditert-butylphosphanylpropane-1-sulfonic acid |
| InChI Key | JPNPRWMRUCIEMN-UHFFFAOYSA-N |
| Molecular Formula | C11H25O3PS |
8-Ethoxyquinoline-5-sulfonic acid monohydrate, 99%
CAS: 15301-40-3 Molecular Formula: C11H11NO4S Molecular Weight (g/mol): 253.27 MDL Number: MFCD00065059 InChI Key: YAMVZYRZAMBCED-UHFFFAOYSA-N Synonym: actinoquinol,8-ethoxy-5-quinolinesulfonic acid,5-quinolinesulfonic acid, 8-ethoxy,unii-470vqe23o3,8-ethoxy-5-chinolinsulfonsaeure,actinochinolum,actinoquinolum,actinoquinol inn,actinoquinolum inn-latin,sodium tequinol PubChem CID: 23674 IUPAC Name: 8-ethoxyquinoline-5-sulfonic acid SMILES: CCOC1=C2N=CC=CC2=C(C=C1)S(O)(=O)=O
| PubChem CID | 23674 |
|---|---|
| CAS | 15301-40-3 |
| Molecular Weight (g/mol) | 253.27 |
| MDL Number | MFCD00065059 |
| SMILES | CCOC1=C2N=CC=CC2=C(C=C1)S(O)(=O)=O |
| Synonym | actinoquinol,8-ethoxy-5-quinolinesulfonic acid,5-quinolinesulfonic acid, 8-ethoxy,unii-470vqe23o3,8-ethoxy-5-chinolinsulfonsaeure,actinochinolum,actinoquinolum,actinoquinol inn,actinoquinolum inn-latin,sodium tequinol |
| IUPAC Name | 8-ethoxyquinoline-5-sulfonic acid |
| InChI Key | YAMVZYRZAMBCED-UHFFFAOYSA-N |
| Molecular Formula | C11H11NO4S |
TES, 99%
CAS: 7365-44-8 Molecular Formula: C6H15NO6S Molecular Weight (g/mol): 229.247 MDL Number: MFCD00007532 InChI Key: JOCBASBOOFNAJA-UHFFFAOYSA-N Synonym: tes,n-tris hydroxymethyl methyl-2-aminoethanesulfonic acid,tes buffer,tes free acid,ethanesulfonic acid, 2-2-hydroxy-1,1-bis hydroxymethyl ethyl amino,2-1,3-dihydroxy-2-hydroxymethyl propan-2-yl amino ethanesulfonic acid,2-2-hydroxy-1,1-dihydroxymethyl-ethylamino-ethanesulfonic acid,tris hydroxymethyl methyl-2-aminomethane sulfonic acid,2-tris hydroxymethyl methylamino ethane-1-sulphonic acid,n-tri hydroxymethyl methyltaurine PubChem CID: 81831 ChEBI: CHEBI:44356 IUPAC Name: 2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]ethanesulfonic acid SMILES: C(CS(=O)(=O)O)NC(CO)(CO)CO
| PubChem CID | 81831 |
|---|---|
| CAS | 7365-44-8 |
| Molecular Weight (g/mol) | 229.247 |
| ChEBI | CHEBI:44356 |
| MDL Number | MFCD00007532 |
| SMILES | C(CS(=O)(=O)O)NC(CO)(CO)CO |
| Synonym | tes,n-tris hydroxymethyl methyl-2-aminoethanesulfonic acid,tes buffer,tes free acid,ethanesulfonic acid, 2-2-hydroxy-1,1-bis hydroxymethyl ethyl amino,2-1,3-dihydroxy-2-hydroxymethyl propan-2-yl amino ethanesulfonic acid,2-2-hydroxy-1,1-dihydroxymethyl-ethylamino-ethanesulfonic acid,tris hydroxymethyl methyl-2-aminomethane sulfonic acid,2-tris hydroxymethyl methylamino ethane-1-sulphonic acid,n-tri hydroxymethyl methyltaurine |
| IUPAC Name | 2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]ethanesulfonic acid |
| InChI Key | JOCBASBOOFNAJA-UHFFFAOYSA-N |
| Molecular Formula | C6H15NO6S |
3-Pyridinesulfonic acid, 98%
CAS: 636-73-7 Molecular Formula: C5H4NO3S Molecular Weight (g/mol): 158.15 MDL Number: MFCD00006381 InChI Key: DVECLMOWYVDJRM-UHFFFAOYSA-M Synonym: 3-pyridinesulfonic acid,pyridine-3-sulphonic acid,3-pyridylsulfonic acid,3-pyridine sulfonic acid,3-sulfopyridine,beta-sulfopyridine,3-pyridinesulfonicacid,pubchem9608,pyridin-3-sulfonic acid,acmc-209nh7 PubChem CID: 69468 IUPAC Name: pyridine-3-sulfonic acid SMILES: [O-]S(=O)(=O)C1=CC=CN=C1
| PubChem CID | 69468 |
|---|---|
| CAS | 636-73-7 |
| Molecular Weight (g/mol) | 158.15 |
| MDL Number | MFCD00006381 |
| SMILES | [O-]S(=O)(=O)C1=CC=CN=C1 |
| Synonym | 3-pyridinesulfonic acid,pyridine-3-sulphonic acid,3-pyridylsulfonic acid,3-pyridine sulfonic acid,3-sulfopyridine,beta-sulfopyridine,3-pyridinesulfonicacid,pubchem9608,pyridin-3-sulfonic acid,acmc-209nh7 |
| IUPAC Name | pyridine-3-sulfonic acid |
| InChI Key | DVECLMOWYVDJRM-UHFFFAOYSA-M |
| Molecular Formula | C5H4NO3S |
3-[Bis(2-hydroxyethyl)amino]-2-hydroxypropanesulfonic acid, 99%
CAS: 68399-80-4 Molecular Formula: C7H17NO6S Molecular Weight (g/mol): 243.274 MDL Number: MFCD00038353 InChI Key: XCBLFURAFHFFJF-UHFFFAOYSA-N Synonym: dipso,3-bis 2-hydroxyethyl amino-2-hydroxypropane-1-sulfonic acid,3-n,n-bis 2-hydroxyethyl amino-2-hydroxypropanesulfonic acid,3-n,n-bis 2-hydroxyethyl amino-2-hydroxy-1-propanesulfonic acid,1-propanesulfonic acid, 3-bis 2-hydroxyethyl amino-2-hydroxy,3-bis 2-hydroxyethyl amino-2-hydroxypropanesulfonic acid,3-bis 2-hydroxyethyl amino-2-hydroxy-1-propanesulfonic acid,n,n-bis 2-hydroxyethyl-3-amino-2-hydroxypropanesulfonic acid PubChem CID: 100210 IUPAC Name: 3-[bis(2-hydroxyethyl)amino]-2-hydroxypropane-1-sulfonic acid SMILES: C(CO)N(CCO)CC(CS(=O)(=O)O)O
| PubChem CID | 100210 |
|---|---|
| CAS | 68399-80-4 |
| Molecular Weight (g/mol) | 243.274 |
| MDL Number | MFCD00038353 |
| SMILES | C(CO)N(CCO)CC(CS(=O)(=O)O)O |
| Synonym | dipso,3-bis 2-hydroxyethyl amino-2-hydroxypropane-1-sulfonic acid,3-n,n-bis 2-hydroxyethyl amino-2-hydroxypropanesulfonic acid,3-n,n-bis 2-hydroxyethyl amino-2-hydroxy-1-propanesulfonic acid,1-propanesulfonic acid, 3-bis 2-hydroxyethyl amino-2-hydroxy,3-bis 2-hydroxyethyl amino-2-hydroxypropanesulfonic acid,3-bis 2-hydroxyethyl amino-2-hydroxy-1-propanesulfonic acid,n,n-bis 2-hydroxyethyl-3-amino-2-hydroxypropanesulfonic acid |
| IUPAC Name | 3-[bis(2-hydroxyethyl)amino]-2-hydroxypropane-1-sulfonic acid |
| InChI Key | XCBLFURAFHFFJF-UHFFFAOYSA-N |
| Molecular Formula | C7H17NO6S |
1-Butanesulfonic Acid, Sodium Salt, BAKER™, J.T. Baker™
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
| 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 |