
Organic acids and derivatives























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Ethyl propiolate, 99%
CAS: 623-47-2 Molecular Formula: C5H6O2 Molecular Weight (g/mol): 98.10 MDL Number: MFCD00009184 InChI Key: FMVJYQGSRWVMQV-UHFFFAOYSA-N Synonym: ethyl propiolate,ethyl acetylenecarboxylate,2-propynoic acid, ethyl ester,propiolic acid ethyl ester,ethyl propynoate,ethoxycarbonyl acetylene,ethyl 2-propynoate,propiolic acid, ethyl ester,unii-w235g5u52s,propynoic acid ethyl ester PubChem CID: 12182 ChEBI: CHEBI:51740 IUPAC Name: ethyl prop-2-ynoate SMILES: CCOC(=O)C#C

PubChem CID | 12182 |
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CAS | 623-47-2 |
Molecular Weight (g/mol) | 98.10 |
ChEBI | CHEBI:51740 |
MDL Number | MFCD00009184 |
SMILES | CCOC(=O)C#C |
Synonym | ethyl propiolate,ethyl acetylenecarboxylate,2-propynoic acid, ethyl ester,propiolic acid ethyl ester,ethyl propynoate,ethoxycarbonyl acetylene,ethyl 2-propynoate,propiolic acid, ethyl ester,unii-w235g5u52s,propynoic acid ethyl ester |
IUPAC Name | ethyl prop-2-ynoate |
InChI Key | FMVJYQGSRWVMQV-UHFFFAOYSA-N |
Molecular Formula | C5H6O2 |
Diethyl 2-bromoethylphosphonate, 97%
CAS: 5324-30-1 Molecular Formula: C6H14BrO3P Molecular Weight (g/mol): 245.05 MDL Number: MFCD00000239 InChI Key: PINITSMLVXAASM-UHFFFAOYSA-N Synonym: diethyl 2-bromoethyl phosphonate,diethyl 2-bromoethylphosphonate,phosphonic acid, 2-bromoethyl-, diethyl ester,2-bromoethyl phosphonic acid diethyl ester,o,o-diethyl 2-bromoethyl phosphonate,diethyl bromoethylphosphonate,diethyl-2-bromoethyl-phosphonate,pinitsmlvxaasm-uhfffaoysa,diethyl-2-bromoethyl phosphonate PubChem CID: 79218 SMILES: CCOP(=O)(CCBr)OCC

PubChem CID | 79218 |
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CAS | 5324-30-1 |
Molecular Weight (g/mol) | 245.05 |
MDL Number | MFCD00000239 |
SMILES | CCOP(=O)(CCBr)OCC |
Synonym | diethyl 2-bromoethyl phosphonate,diethyl 2-bromoethylphosphonate,phosphonic acid, 2-bromoethyl-, diethyl ester,2-bromoethyl phosphonic acid diethyl ester,o,o-diethyl 2-bromoethyl phosphonate,diethyl bromoethylphosphonate,diethyl-2-bromoethyl-phosphonate,pinitsmlvxaasm-uhfffaoysa,diethyl-2-bromoethyl phosphonate |
InChI Key | PINITSMLVXAASM-UHFFFAOYSA-N |
Molecular Formula | C6H14BrO3P |
Diethyl cyanomethylphosphonate, 96%
CAS: 2537-48-6 Molecular Formula: C6H12NO3P Molecular Weight (g/mol): 177.14 MDL Number: MFCD00001893 InChI Key: KWMBADTWRIGGGG-UHFFFAOYSA-N Synonym: diethyl cyanomethylphosphonate,diethyl cyanomethyl phosphonate,diethylphosphono acetonitrile,cyanomethylphosphonic acid diethyl ester,diethylphosphonoacetonitrile,diethylcyanomethylphosphonate,diethyl cyanomethanephosphonate,phosphonic acid, cyanomethyl-, diethyl ester,cyanomethyl phosphonic acid diethyl ester PubChem CID: 75676 IUPAC Name: 2-diethoxyphosphorylacetonitrile SMILES: CCOP(=O)(CC#N)OCC

PubChem CID | 75676 |
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CAS | 2537-48-6 |
Molecular Weight (g/mol) | 177.14 |
MDL Number | MFCD00001893 |
SMILES | CCOP(=O)(CC#N)OCC |
Synonym | diethyl cyanomethylphosphonate,diethyl cyanomethyl phosphonate,diethylphosphono acetonitrile,cyanomethylphosphonic acid diethyl ester,diethylphosphonoacetonitrile,diethylcyanomethylphosphonate,diethyl cyanomethanephosphonate,phosphonic acid, cyanomethyl-, diethyl ester,cyanomethyl phosphonic acid diethyl ester |
IUPAC Name | 2-diethoxyphosphorylacetonitrile |
InChI Key | KWMBADTWRIGGGG-UHFFFAOYSA-N |
Molecular Formula | C6H12NO3P |
DL-Ethyl 2-bromovalerate, 99%, Thermo Scientific™
CAS: 615-83-8 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.08 MDL Number: MFCD00000159 InChI Key: ORSIRXYHFPHWTN-UHFFFAOYSA-N PubChem CID: 79071 IUPAC Name: ethyl 2-bromopentanoate SMILES: CCCC(C(=O)OCC)Br

PubChem CID | 79071 |
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CAS | 615-83-8 |
Molecular Weight (g/mol) | 209.08 |
MDL Number | MFCD00000159 |
SMILES | CCCC(C(=O)OCC)Br |
IUPAC Name | ethyl 2-bromopentanoate |
InChI Key | ORSIRXYHFPHWTN-UHFFFAOYSA-N |
Molecular Formula | C7H13BrO2 |
4-Hydroxy-6-methyl-2-pyrone, 98%
CAS: 675-10-5 Molecular Formula: C6H6O3 Molecular Weight (g/mol): 126.11 MDL Number: MFCD00006641,MFCD18820248 InChI Key: OOKCZXGEYPSNIM-UHFFFAOYSA-N Synonym: 4-hydroxy-6-methyl-2-pyrone,2-hydroxy-6-methyl-4h-pyran-4-one,4-hydroxy-6-methyl-2h-pyran-2-one,triacetic acid lactone,triacetate lactone,2h-pyran-2-one, 4-hydroxy-6-methyl,6-methyl-4-hydroxypyron-2,unii-s1s883s4ee,6-methyl-4-hydroxy-2-pyrone,ccris 3600 PubChem CID: 54675757 ChEBI: CHEBI:16458 IUPAC Name: 4-hydroxy-6-methylpyran-2-one SMILES: CC1=CC(=O)C=C(O)O1

PubChem CID | 54675757 |
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CAS | 675-10-5 |
Molecular Weight (g/mol) | 126.11 |
ChEBI | CHEBI:16458 |
MDL Number | MFCD00006641,MFCD18820248 |
SMILES | CC1=CC(=O)C=C(O)O1 |
Synonym | 4-hydroxy-6-methyl-2-pyrone,2-hydroxy-6-methyl-4h-pyran-4-one,4-hydroxy-6-methyl-2h-pyran-2-one,triacetic acid lactone,triacetate lactone,2h-pyran-2-one, 4-hydroxy-6-methyl,6-methyl-4-hydroxypyron-2,unii-s1s883s4ee,6-methyl-4-hydroxy-2-pyrone,ccris 3600 |
IUPAC Name | 4-hydroxy-6-methylpyran-2-one |
InChI Key | OOKCZXGEYPSNIM-UHFFFAOYSA-N |
Molecular Formula | C6H6O3 |
4-(2-Keto-1-benzimidazolinyl)piperidine, 97%
CAS: 20662-53-7 Molecular Formula: C12H15N3O Molecular Weight (g/mol): 217.27 MDL Number: MFCD00005714 InChI Key: BYNBAMHAURJNTR-UHFFFAOYSA-N Synonym: 4-2-keto-1-benzimidazolinyl piperidine,1-piperidin-4-yl-1h-benzo d imidazol-2 3h-one,4-2-keto-1-benzimidozolinyl piperidine,unii-4rp0aed2pc,1-piperidin-4-yl-1h-benzimidazol-2-ol,4rp0aed2pc,1-4-piperidinyl-1,3-dihydro-2h-benzimidazol-2-one,1-piperidin-4-yl-2,3-dihydro-1h-1,3-benzodiazol-2-one,1-piperidin-4-yl-3h-1,3-benzodiazol-2-one,1,3-dihydro-1-4-piperidinyl-2h-benzimidazol-2-one PubChem CID: 88638 SMILES: O=C1NC2=CC=CC=C2N1C1CCNCC1

PubChem CID | 88638 |
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CAS | 20662-53-7 |
Molecular Weight (g/mol) | 217.27 |
MDL Number | MFCD00005714 |
SMILES | O=C1NC2=CC=CC=C2N1C1CCNCC1 |
Synonym | 4-2-keto-1-benzimidazolinyl piperidine,1-piperidin-4-yl-1h-benzo d imidazol-2 3h-one,4-2-keto-1-benzimidozolinyl piperidine,unii-4rp0aed2pc,1-piperidin-4-yl-1h-benzimidazol-2-ol,4rp0aed2pc,1-4-piperidinyl-1,3-dihydro-2h-benzimidazol-2-one,1-piperidin-4-yl-2,3-dihydro-1h-1,3-benzodiazol-2-one,1-piperidin-4-yl-3h-1,3-benzodiazol-2-one,1,3-dihydro-1-4-piperidinyl-2h-benzimidazol-2-one |
InChI Key | BYNBAMHAURJNTR-UHFFFAOYSA-N |
Molecular Formula | C12H15N3O |
Dimethyl (2-oxopropyl)phosphonate, 95%
CAS: 4202-14-6 Molecular Formula: C5H11O4P Molecular Weight (g/mol): 166.11 MDL Number: MFCD00008769 InChI Key: UOWIYNWMROWVDG-UHFFFAOYSA-N Synonym: dimethyl 2-oxopropyl phosphonate,dimethyl acetylmethylphosphonate,dimethyl 2-oxopropylphosphonate,dimethyl acetonylphosphonate,2-oxopropyl phosphonic acid dimethyl ester,1-dimethoxycarbonyl acetone,acmc-209jmw,dimethoxyphosphoryl acetone PubChem CID: 77872 IUPAC Name: 1-dimethoxyphosphorylpropan-2-one SMILES: CC(=O)CP(=O)(OC)OC

PubChem CID | 77872 |
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CAS | 4202-14-6 |
Molecular Weight (g/mol) | 166.11 |
MDL Number | MFCD00008769 |
SMILES | CC(=O)CP(=O)(OC)OC |
Synonym | dimethyl 2-oxopropyl phosphonate,dimethyl acetylmethylphosphonate,dimethyl 2-oxopropylphosphonate,dimethyl acetonylphosphonate,2-oxopropyl phosphonic acid dimethyl ester,1-dimethoxycarbonyl acetone,acmc-209jmw,dimethoxyphosphoryl acetone |
IUPAC Name | 1-dimethoxyphosphorylpropan-2-one |
InChI Key | UOWIYNWMROWVDG-UHFFFAOYSA-N |
Molecular Formula | C5H11O4P |
N-(2-Aminoethyl)acetamide, 90%, Thermo Scientific Chemicals
CAS: 1001-53-2 Molecular Formula: C4H10N2O Molecular Weight (g/mol): 102.14 MDL Number: MFCD00008163 InChI Key: DAKZISABEDGGSV-UHFFFAOYSA-N Synonym: n-2-aminoethyl acetamide,n-acetylethylenediamine,acetamide, n-2-aminoethyl,n-2-amino-ethyl-acetamide,unii-fql33v3kzd,fql33v3kzd,acetylethylenediamine,2-acetamidoethylamine,acetylethylene diamine,n-acetylethylendiamine PubChem CID: 66082 IUPAC Name: N-(2-aminoethyl)acetamide SMILES: CC(=O)NCCN

PubChem CID | 66082 |
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CAS | 1001-53-2 |
Molecular Weight (g/mol) | 102.14 |
MDL Number | MFCD00008163 |
SMILES | CC(=O)NCCN |
Synonym | n-2-aminoethyl acetamide,n-acetylethylenediamine,acetamide, n-2-aminoethyl,n-2-amino-ethyl-acetamide,unii-fql33v3kzd,fql33v3kzd,acetylethylenediamine,2-acetamidoethylamine,acetylethylene diamine,n-acetylethylendiamine |
IUPAC Name | N-(2-aminoethyl)acetamide |
InChI Key | DAKZISABEDGGSV-UHFFFAOYSA-N |
Molecular Formula | C4H10N2O |
Tetraethyl methylenediphosphonate, 97%
CAS: 1660-94-2 Molecular Formula: C9H22O6P2 Molecular Weight (g/mol): 288.22 MDL Number: MFCD00039887 InChI Key: STJWVOQLJPNAQL-UHFFFAOYSA-N Synonym: tetraethyl methylenediphosphonate,tetraethyl methanediphosphonate,tetraethyl diphosphonomethane,methylenebis diethylphosphonate,tetraethyl methylenebisphosphonate,phosphonic acid, methylenebis-, tetraethyl ester,methylenebis diethoxyphosphine oxide,methylenebisphosphonic acid, tetraethyl ester,phosphonic acid, methylenedi-, tetraethyl ester,methylenedi phosphonic acid tetraethyl ester PubChem CID: 15455 IUPAC Name: 1-[diethoxyphosphorylmethyl(ethoxy)phosphoryl]oxyethane SMILES: CCOP(=O)(CP(=O)(OCC)OCC)OCC

PubChem CID | 15455 |
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CAS | 1660-94-2 |
Molecular Weight (g/mol) | 288.22 |
MDL Number | MFCD00039887 |
SMILES | CCOP(=O)(CP(=O)(OCC)OCC)OCC |
Synonym | tetraethyl methylenediphosphonate,tetraethyl methanediphosphonate,tetraethyl diphosphonomethane,methylenebis diethylphosphonate,tetraethyl methylenebisphosphonate,phosphonic acid, methylenebis-, tetraethyl ester,methylenebis diethoxyphosphine oxide,methylenebisphosphonic acid, tetraethyl ester,phosphonic acid, methylenedi-, tetraethyl ester,methylenedi phosphonic acid tetraethyl ester |
IUPAC Name | 1-[diethoxyphosphorylmethyl(ethoxy)phosphoryl]oxyethane |
InChI Key | STJWVOQLJPNAQL-UHFFFAOYSA-N |
Molecular Formula | C9H22O6P2 |
1-Naphthyl acetate, 99%, Thermo Scientific Chemicals
CAS: 830-81-9 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00003922 InChI Key: VGKONPUVOVVNSU-UHFFFAOYSA-N Synonym: 1-naphthyl acetate,1-acetoxynaphthalene,alpha-naphthyl acetate,1-naphthol, acetate,a-naphthyl acetate,naphthyl acetate,naphthalene, 1-acetoxy,1-naphthalenol, acetate,acetic acid 1-naphthyl ester,alpha-naphthol acetate PubChem CID: 13247 IUPAC Name: naphthalen-1-yl acetate SMILES: CC(=O)OC1=CC=CC2=CC=CC=C21

PubChem CID | 13247 |
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CAS | 830-81-9 |
Molecular Weight (g/mol) | 186.21 |
MDL Number | MFCD00003922 |
SMILES | CC(=O)OC1=CC=CC2=CC=CC=C21 |
Synonym | 1-naphthyl acetate,1-acetoxynaphthalene,alpha-naphthyl acetate,1-naphthol, acetate,a-naphthyl acetate,naphthyl acetate,naphthalene, 1-acetoxy,1-naphthalenol, acetate,acetic acid 1-naphthyl ester,alpha-naphthol acetate |
IUPAC Name | naphthalen-1-yl acetate |
InChI Key | VGKONPUVOVVNSU-UHFFFAOYSA-N |
Molecular Formula | C12H10O2 |
Isopropyl acetate, 99+%, for analysis
CAS: 108-21-4 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.13 MDL Number: MFCD00008877 InChI Key: JMMWKPVZQRWMSS-UHFFFAOYSA-N Synonym: isopropyl acetate,2-propyl acetate,2-acetoxypropane,acetic acid, 1-methylethyl ester,isopropyl ethanoate,isopropylacetat,paracetat,isopropylacetaat,1-methylethyl acetate,acetic acid, isopropyl ester PubChem CID: 7915 IUPAC Name: propan-2-yl acetate SMILES: CC(C)OC(=O)C

PubChem CID | 7915 |
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CAS | 108-21-4 |
Molecular Weight (g/mol) | 102.13 |
MDL Number | MFCD00008877 |
SMILES | CC(C)OC(=O)C |
Synonym | isopropyl acetate,2-propyl acetate,2-acetoxypropane,acetic acid, 1-methylethyl ester,isopropyl ethanoate,isopropylacetat,paracetat,isopropylacetaat,1-methylethyl acetate,acetic acid, isopropyl ester |
IUPAC Name | propan-2-yl acetate |
InChI Key | JMMWKPVZQRWMSS-UHFFFAOYSA-N |
Molecular Formula | C5H10O2 |
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

PubChem CID | 4096517 |
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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 |
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole, 97+%
CAS: 269410-08-4 Molecular Formula: C9H15BN2O2 Molecular Weight (g/mol): 194.04 MDL Number: MFCD03453063 InChI Key: TVOJIBGZFYMWDT-UHFFFAOYSA-N Synonym: 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,pyrazole-4-boronic acid pinacol ester,4-pyrazoleboronic acid pinacol ester,1h-pyrazole-4-boronic acid pinacol ester,4-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,1h-pyrazole-4-boronic acid, pinacol ester,4,4,5,5-tetramethyl-2-1h-pyrazol-4-yl-1,3,2-dioxaborolane,pyrazole-4-boronic acid, pinacol ester,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole,2-4-pyrazolyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane PubChem CID: 2774010 IUPAC Name: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole SMILES: CC1(C)OB(OC1(C)C)C1=CNN=C1

PubChem CID | 2774010 |
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CAS | 269410-08-4 |
Molecular Weight (g/mol) | 194.04 |
MDL Number | MFCD03453063 |
SMILES | CC1(C)OB(OC1(C)C)C1=CNN=C1 |
Synonym | 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,pyrazole-4-boronic acid pinacol ester,4-pyrazoleboronic acid pinacol ester,1h-pyrazole-4-boronic acid pinacol ester,4-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,1h-pyrazole-4-boronic acid, pinacol ester,4,4,5,5-tetramethyl-2-1h-pyrazol-4-yl-1,3,2-dioxaborolane,pyrazole-4-boronic acid, pinacol ester,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole,2-4-pyrazolyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
IUPAC Name | 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole |
InChI Key | TVOJIBGZFYMWDT-UHFFFAOYSA-N |
Molecular Formula | C9H15BN2O2 |
4'-Iodoacetanilide, 97%
CAS: 622-50-4 Molecular Formula: C8H8INO Molecular Weight (g/mol): 261.06 MDL Number: MFCD00016352 InChI Key: SIULLDWIXYYVCU-UHFFFAOYSA-N Synonym: n-4-iodophenyl acetamide,4-iodoacetanilide,4'-iodoacetanilide,p-iodoacetanilide,acetamide, n-4-iodophenyl,acetanilide, 4'-iodo,4'-iodo-acetanilide,pubchem3293,acmc-20akb8,maybridge1_006480 PubChem CID: 12147 IUPAC Name: N-(4-iodophenyl)acetamide SMILES: CC(=O)NC1=CC=C(C=C1)I

PubChem CID | 12147 |
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CAS | 622-50-4 |
Molecular Weight (g/mol) | 261.06 |
MDL Number | MFCD00016352 |
SMILES | CC(=O)NC1=CC=C(C=C1)I |
Synonym | n-4-iodophenyl acetamide,4-iodoacetanilide,4'-iodoacetanilide,p-iodoacetanilide,acetamide, n-4-iodophenyl,acetanilide, 4'-iodo,4'-iodo-acetanilide,pubchem3293,acmc-20akb8,maybridge1_006480 |
IUPAC Name | N-(4-iodophenyl)acetamide |
InChI Key | SIULLDWIXYYVCU-UHFFFAOYSA-N |
Molecular Formula | C8H8INO |
1-Propanesulfonic acid, 95%
CAS: 5284-66-2 Molecular Formula: C3H8O3S Molecular Weight (g/mol): 124.16 MDL Number: MFCD00041889 InChI Key: KCXFHTAICRTXLI-UHFFFAOYSA-N Synonym: 1-propanesulfonic acid,propanesulfonic acid,propylsulfonic acid,propanesulfonate,propanesulphonic acid,ammonium propanesulfonate,propane-1-sulphonic acid,ncistruc1_001874,ncistruc2_000257,1-propanesulfonic acid, technical t PubChem CID: 78938 IUPAC Name: propane-1-sulfonic acid SMILES: CCCS(=O)(=O)O

PubChem CID | 78938 |
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CAS | 5284-66-2 |
Molecular Weight (g/mol) | 124.16 |
MDL Number | MFCD00041889 |
SMILES | CCCS(=O)(=O)O |
Synonym | 1-propanesulfonic acid,propanesulfonic acid,propylsulfonic acid,propanesulfonate,propanesulphonic acid,ammonium propanesulfonate,propane-1-sulphonic acid,ncistruc1_001874,ncistruc2_000257,1-propanesulfonic acid, technical t |
IUPAC Name | propane-1-sulfonic acid |
InChI Key | KCXFHTAICRTXLI-UHFFFAOYSA-N |
Molecular Formula | C3H8O3S |