Organic acids and derivatives
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m-Toluenesulfonic acid monohydrate, 97%
CAS: 312619-56-0 Molecular Formula: C7H10O4S Molecular Weight (g/mol): 190.213 MDL Number: MFCD00167130 InChI Key: GHLYGGIKYFLYTH-UHFFFAOYSA-N Synonym: 3-methylbenzenesulfonic acid hydrate,m-toluenesulfonic acid monohydrate,m-toluenesulfonic acid hydrate,acmc-20akdl,m-toluenesulfonic acid 1-hydrate,3-toluenesulfonic acid 1-hydrate,3-methylbenzenesulfonic acid hydrate 1:x,benzenesulfonicacid, 3-methyl-, hydrate 1:1 PubChem CID: 53249652 IUPAC Name: 3-methylbenzenesulfonic acid;hydrate SMILES: CC1=CC(=CC=C1)S(=O)(=O)O.O
| PubChem CID | 53249652 |
|---|---|
| CAS | 312619-56-0 |
| Molecular Weight (g/mol) | 190.213 |
| MDL Number | MFCD00167130 |
| SMILES | CC1=CC(=CC=C1)S(=O)(=O)O.O |
| Synonym | 3-methylbenzenesulfonic acid hydrate,m-toluenesulfonic acid monohydrate,m-toluenesulfonic acid hydrate,acmc-20akdl,m-toluenesulfonic acid 1-hydrate,3-toluenesulfonic acid 1-hydrate,3-methylbenzenesulfonic acid hydrate 1:x,benzenesulfonicacid, 3-methyl-, hydrate 1:1 |
| IUPAC Name | 3-methylbenzenesulfonic acid;hydrate |
| InChI Key | GHLYGGIKYFLYTH-UHFFFAOYSA-N |
| Molecular Formula | C7H10O4S |
Dimethyl Sulfate, 98%, Spectrum™ Chemical
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CAS: 77-78-1
| CAS | 77-78-1 |
|---|
2-Chloro-2',6'-dimethylacetanilide, 99%
CAS: 1131-01-7 Molecular Formula: C10H12ClNO Molecular Weight (g/mol): 197.662 MDL Number: MFCD00000926 InChI Key: FPQQSNUTBWFFLB-UHFFFAOYSA-N Synonym: 2-chloro-n-2,6-dimethylphenyl acetamide,2-chloro-2',6'-dimethylacetanilide,n-chloroacetyl-2,6-dimethylaniline,2-chloro-2',6'-acetoxylidide,chloroaceto-2,6-xylidide,acetamide, 2-chloro-n-2,6-dimethylphenyl,chloroacetamido-2,6-xylidine,1-chloroacetylamino-2,6-dimethylbenzene,n-2,6-dimethylphenyl-2-chloroacetamide,unii-5d2b69oapx PubChem CID: 70798 IUPAC Name: 2-chloro-N-(2,6-dimethylphenyl)acetamide SMILES: CC1=C(C(=CC=C1)C)NC(=O)CCl
| PubChem CID | 70798 |
|---|---|
| CAS | 1131-01-7 |
| Molecular Weight (g/mol) | 197.662 |
| MDL Number | MFCD00000926 |
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)CCl |
| Synonym | 2-chloro-n-2,6-dimethylphenyl acetamide,2-chloro-2',6'-dimethylacetanilide,n-chloroacetyl-2,6-dimethylaniline,2-chloro-2',6'-acetoxylidide,chloroaceto-2,6-xylidide,acetamide, 2-chloro-n-2,6-dimethylphenyl,chloroacetamido-2,6-xylidine,1-chloroacetylamino-2,6-dimethylbenzene,n-2,6-dimethylphenyl-2-chloroacetamide,unii-5d2b69oapx |
| IUPAC Name | 2-chloro-N-(2,6-dimethylphenyl)acetamide |
| InChI Key | FPQQSNUTBWFFLB-UHFFFAOYSA-N |
| Molecular Formula | C10H12ClNO |
N,N-Dimethylformamide dineopentyl acetal, 98%
CAS: 4909-78-8 Molecular Formula: C13H30NO2 Molecular Weight (g/mol): 232.39 MDL Number: MFCD00008851 InChI Key: KEXFRBIOHPDZQM-UHFFFAOYSA-O Synonym: n,n-dimethylformamide dineopentyl acetal,methanamine, 1,1-bis 2,2-dimethylpropoxy-n,n-dimethyl,n,n-dimethyl-1,1-bis neopentyloxy methanamine,dimethylformamide dineopentyl acetal,1,1-bis 2,2-dimethylpropoxy-n,n-dimethylmethanamine,bis 2,2-dimethylpropoxy methyl dimethylamine,acmc-1al8s,1,1-bis 2,2-dimethylpropoxy-n,n,n-trimethylamine,1,1-dineopentyloxytrimethylamine,dimethylformamide dineopentylacetal PubChem CID: 78623 IUPAC Name: 1,1-bis(2,2-dimethylpropoxy)-N,N-dimethylmethanamine SMILES: C[NH+](C)C(OCC(C)(C)C)OCC(C)(C)C
| PubChem CID | 78623 |
|---|---|
| CAS | 4909-78-8 |
| Molecular Weight (g/mol) | 232.39 |
| MDL Number | MFCD00008851 |
| SMILES | C[NH+](C)C(OCC(C)(C)C)OCC(C)(C)C |
| Synonym | n,n-dimethylformamide dineopentyl acetal,methanamine, 1,1-bis 2,2-dimethylpropoxy-n,n-dimethyl,n,n-dimethyl-1,1-bis neopentyloxy methanamine,dimethylformamide dineopentyl acetal,1,1-bis 2,2-dimethylpropoxy-n,n-dimethylmethanamine,bis 2,2-dimethylpropoxy methyl dimethylamine,acmc-1al8s,1,1-bis 2,2-dimethylpropoxy-n,n,n-trimethylamine,1,1-dineopentyloxytrimethylamine,dimethylformamide dineopentylacetal |
| IUPAC Name | 1,1-bis(2,2-dimethylpropoxy)-N,N-dimethylmethanamine |
| InChI Key | KEXFRBIOHPDZQM-UHFFFAOYSA-O |
| Molecular Formula | C13H30NO2 |
Potassium Methyl Sulfate, MP Biomedicals™
CAS: 562-54-9 Molecular Formula: CH3KO4S Molecular Weight (g/mol): 150.19 MDL Number: MFCD00040472 InChI Key: WBGWGHYJIFOATF-UHFFFAOYSA-M Synonym: Methylsulfuric acid potassium salt,Methyl sulfate potassium salt IUPAC Name: potassium methyl sulfate SMILES: [K+].COS([O-])(=O)=O
| CAS | 562-54-9 |
|---|---|
| Molecular Weight (g/mol) | 150.19 |
| MDL Number | MFCD00040472 |
| SMILES | [K+].COS([O-])(=O)=O |
| Synonym | Methylsulfuric acid potassium salt,Methyl sulfate potassium salt |
| IUPAC Name | potassium methyl sulfate |
| InChI Key | WBGWGHYJIFOATF-UHFFFAOYSA-M |
| Molecular Formula | CH3KO4S |
2,2-Bis(hydroxymethyl)propionic acid, 98+%
CAS: 4767-03-7 Molecular Formula: C5H10O4 Molecular Weight (g/mol): 134.13 MDL Number: MFCD00004199 InChI Key: PTBDIHRZYDMNKB-UHFFFAOYSA-N Synonym: 2,2-bis hydroxymethyl propionic acid,dimethylolpropionic acid,3-hydroxy-2-hydroxymethyl-2-methylpropanoic acid,2,2-bis hydroxymethyl propanoic acid,propanoic acid, 3-hydroxy-2-hydroxymethyl-2-methyl,2,2-dimethylolpropionic acid,dimethylol propionic acid,2,2-bis hydroxymethyl propanoicacid,unii-4nhi8v17mn,4nhi8v17mn PubChem CID: 78501 IUPAC Name: 3-hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid SMILES: CC(CO)(CO)C(=O)O
| PubChem CID | 78501 |
|---|---|
| CAS | 4767-03-7 |
| Molecular Weight (g/mol) | 134.13 |
| MDL Number | MFCD00004199 |
| SMILES | CC(CO)(CO)C(=O)O |
| Synonym | 2,2-bis hydroxymethyl propionic acid,dimethylolpropionic acid,3-hydroxy-2-hydroxymethyl-2-methylpropanoic acid,2,2-bis hydroxymethyl propanoic acid,propanoic acid, 3-hydroxy-2-hydroxymethyl-2-methyl,2,2-dimethylolpropionic acid,dimethylol propionic acid,2,2-bis hydroxymethyl propanoicacid,unii-4nhi8v17mn,4nhi8v17mn |
| IUPAC Name | 3-hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid |
| InChI Key | PTBDIHRZYDMNKB-UHFFFAOYSA-N |
| Molecular Formula | C5H10O4 |
Diethyl 1-decylphosphonate, 97%
CAS: 16165-68-7 Molecular Formula: C14H31O3P Molecular Weight (g/mol): 278.373 MDL Number: MFCD00015593 InChI Key: HYQXIVAZQBYBAF-UHFFFAOYSA-N Synonym: diethyl 1-decylphosphonate,diethyl decylphosphonate,decylphosphonic acid diethyl ester,decyldiethoxyphosphino-1-one,acmc-20al9l,diethyl n-decanephosphonate,diethyl 1-decanephosphonate,diethyl 1-decyl phosphonate,decyl-phosphonic acid diethyl ester,n-decylphosphonic acid diethyl ester PubChem CID: 2773697 IUPAC Name: 1-diethoxyphosphoryldecane SMILES: CCCCCCCCCCP(=O)(OCC)OCC
| PubChem CID | 2773697 |
|---|---|
| CAS | 16165-68-7 |
| Molecular Weight (g/mol) | 278.373 |
| MDL Number | MFCD00015593 |
| SMILES | CCCCCCCCCCP(=O)(OCC)OCC |
| Synonym | diethyl 1-decylphosphonate,diethyl decylphosphonate,decylphosphonic acid diethyl ester,decyldiethoxyphosphino-1-one,acmc-20al9l,diethyl n-decanephosphonate,diethyl 1-decanephosphonate,diethyl 1-decyl phosphonate,decyl-phosphonic acid diethyl ester,n-decylphosphonic acid diethyl ester |
| IUPAC Name | 1-diethoxyphosphoryldecane |
| InChI Key | HYQXIVAZQBYBAF-UHFFFAOYSA-N |
| Molecular Formula | C14H31O3P |
Propargyl methacrylate, 98%, stab. with 200-300ppm 4-methoxyphenol
CAS: 13861-22-8 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.14 MDL Number: MFCD00048123 InChI Key: PZAWASVJOPLHCJ-UHFFFAOYSA-N Synonym: propargyl methacrylate,2-propynyl methacrylate,2-propenoic acid, 2-methyl-, 2-propynyl ester,2-propenoic acid, 2-methyl-, 2-propyn-1-yl ester,prop-2-yn-1-yl 2-methylprop-2-enoate,prop-2-ynyl methacrylate,propargylmethacrylate,acmc-1bvgj,prop-2-yn-1-yl methacrylate,propargyl methacrylate, stabilized 10g PubChem CID: 83778 IUPAC Name: prop-2-ynyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCC#C
| PubChem CID | 83778 |
|---|---|
| CAS | 13861-22-8 |
| Molecular Weight (g/mol) | 124.14 |
| MDL Number | MFCD00048123 |
| SMILES | CC(=C)C(=O)OCC#C |
| Synonym | propargyl methacrylate,2-propynyl methacrylate,2-propenoic acid, 2-methyl-, 2-propynyl ester,2-propenoic acid, 2-methyl-, 2-propyn-1-yl ester,prop-2-yn-1-yl 2-methylprop-2-enoate,prop-2-ynyl methacrylate,propargylmethacrylate,acmc-1bvgj,prop-2-yn-1-yl methacrylate,propargyl methacrylate, stabilized 10g |
| IUPAC Name | prop-2-ynyl 2-methylprop-2-enoate |
| InChI Key | PZAWASVJOPLHCJ-UHFFFAOYSA-N |
| Molecular Formula | C7H8O2 |
2,6-Dichlorobenzeneboronic acid, 95%, Thermo Scientific Chemicals
CAS: 73852-17-2 Molecular Formula: C6H5BCl2O2 Molecular Weight (g/mol): 190.81 MDL Number: MFCD00064869 InChI Key: CXDPUSMFYPQXCV-UHFFFAOYSA-N Synonym: 2,6-dichlorobenzeneboronic acid,2,6-dichlorophenyl boronic acid,2,6-dichlorophenylboronicacid,2,6-dichlorophenyl boranediol,boronic acid, 2,6-dichlorophenyl,pubchem7938,acmc-1bc3m,ksc489k8l,2,6-dichloro-phenylboronic acid PubChem CID: 2734332 IUPAC Name: (2,6-dichlorophenyl)boronic acid SMILES: OB(O)C1=C(Cl)C=CC=C1Cl
| PubChem CID | 2734332 |
|---|---|
| CAS | 73852-17-2 |
| Molecular Weight (g/mol) | 190.81 |
| MDL Number | MFCD00064869 |
| SMILES | OB(O)C1=C(Cl)C=CC=C1Cl |
| Synonym | 2,6-dichlorobenzeneboronic acid,2,6-dichlorophenyl boronic acid,2,6-dichlorophenylboronicacid,2,6-dichlorophenyl boranediol,boronic acid, 2,6-dichlorophenyl,pubchem7938,acmc-1bc3m,ksc489k8l,2,6-dichloro-phenylboronic acid |
| IUPAC Name | (2,6-dichlorophenyl)boronic acid |
| InChI Key | CXDPUSMFYPQXCV-UHFFFAOYSA-N |
| Molecular Formula | C6H5BCl2O2 |
1-Octanesulfonic Acid Sodium Salt, HPLC Grade, J.T. Baker™
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 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 |
| InChI Key | HRQDCDQDOPSGBR-UHFFFAOYSA-M |
| Molecular Formula | C8H17NaO3S |
Ethyl 2-pentynoate, 97+%
CAS: 55314-57-3 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.155 MDL Number: MFCD00015221 InChI Key: XDPRPKSTFBPPHU-UHFFFAOYSA-N PubChem CID: 99169 IUPAC Name: ethyl pent-2-ynoate SMILES: CCC#CC(=O)OCC
| PubChem CID | 99169 |
|---|---|
| CAS | 55314-57-3 |
| Molecular Weight (g/mol) | 126.155 |
| MDL Number | MFCD00015221 |
| SMILES | CCC#CC(=O)OCC |
| IUPAC Name | ethyl pent-2-ynoate |
| InChI Key | XDPRPKSTFBPPHU-UHFFFAOYSA-N |
| Molecular Formula | C7H10O2 |
Ethyl 3-(trifluoromethyl)crotonate, (E)+(Z), 96%
CAS: 24490-03-7 Molecular Formula: C7H9F3O2 Molecular Weight (g/mol): 182.14 MDL Number: MFCD00040846 InChI Key: OSZLARYVWBUKTG-SNAWJCMRSA-N Synonym: ethyl 4,4,4-trifluoro-3-methylbut-2-enoate,ethyl 3-trifluoromethyl crotonate,ethyl 2e-4,4,4-trifluoro-3-methylbut-2-enoate,ethyl 3-trifluoromethyl crotonate, cis + trans,ethyl e-4,4,4-trifluoro-3-methylbut-2-enoate,e-3-trifluoromethyl-2-butenoic acid ethyl ester PubChem CID: 5838607 IUPAC Name: ethyl (E)-4,4,4-trifluoro-3-methylbut-2-enoate SMILES: CCOC(=O)\C=C(/C)C(F)(F)F
| PubChem CID | 5838607 |
|---|---|
| CAS | 24490-03-7 |
| Molecular Weight (g/mol) | 182.14 |
| MDL Number | MFCD00040846 |
| SMILES | CCOC(=O)\C=C(/C)C(F)(F)F |
| Synonym | ethyl 4,4,4-trifluoro-3-methylbut-2-enoate,ethyl 3-trifluoromethyl crotonate,ethyl 2e-4,4,4-trifluoro-3-methylbut-2-enoate,ethyl 3-trifluoromethyl crotonate, cis + trans,ethyl e-4,4,4-trifluoro-3-methylbut-2-enoate,e-3-trifluoromethyl-2-butenoic acid ethyl ester |
| IUPAC Name | ethyl (E)-4,4,4-trifluoro-3-methylbut-2-enoate |
| InChI Key | OSZLARYVWBUKTG-SNAWJCMRSA-N |
| Molecular Formula | C7H9F3O2 |
Diphenylaminesulfonic Acid Sodium Salt, For ACS analysis, MP Biomedicals™
CAS: 6152-67-6 Molecular Formula: C12H11NNaO3S Molecular Weight (g/mol): 272.27 MDL Number: MFCD00036468 InChI Key: VMVSDVIYIMNZBS-UHFFFAOYSA-N Synonym: sodium 4-phenylamino benzenesulfonate,sodium diphenylamine-4-sulfonate,benzenesulfonic acid, 4-phenylamino-, monosodium salt,unii-3e2ux1382o,sodium 4-anilinobenzenesulfonate,diphenylamine-4-sulfonic acid sodium salt,sodium diphenylamine-p-sulfonate,n-phenylsulfanilic acid, sodium salt,4-phenylamino benzenesulfonic acid sodium salt,diphenylaminesulfonic acid sodium salt PubChem CID: 517002 IUPAC Name: 4-(phenylamino)benzene-1-sulfonic acid sodium SMILES: [Na].OS(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1
| PubChem CID | 517002 |
|---|---|
| CAS | 6152-67-6 |
| Molecular Weight (g/mol) | 272.27 |
| MDL Number | MFCD00036468 |
| SMILES | [Na].OS(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1 |
| Synonym | sodium 4-phenylamino benzenesulfonate,sodium diphenylamine-4-sulfonate,benzenesulfonic acid, 4-phenylamino-, monosodium salt,unii-3e2ux1382o,sodium 4-anilinobenzenesulfonate,diphenylamine-4-sulfonic acid sodium salt,sodium diphenylamine-p-sulfonate,n-phenylsulfanilic acid, sodium salt,4-phenylamino benzenesulfonic acid sodium salt,diphenylaminesulfonic acid sodium salt |
| IUPAC Name | 4-(phenylamino)benzene-1-sulfonic acid sodium |
| InChI Key | VMVSDVIYIMNZBS-UHFFFAOYSA-N |
| Molecular Formula | C12H11NNaO3S |
trans-1-Octenylboronic acid pinacol ester, 97%, Thermo Scientific Chemicals
CAS: 83947-55-1 Molecular Formula: C14H27BO2 Molecular Weight (g/mol): 238.178 MDL Number: MFCD03453667 InChI Key: KQTOSGTXAFJZSJ-VAWYXSNFSA-N Synonym: trans-4,4,5,5-tetramethyl-2-oct-1-enyl-1,3,2-dioxaborolane,1-octenylboronic acid pinacol ester,1-octen-1-ylboronic acid, pinacol ester,trans-1-octenylboronic acid pinacol ester,trans-4,4,5,5-tetramethyl-2-1-octenyl-1,3,2-dioxaborolane,e-1-octenylboronic acid pinacol ester,trans-1-octen-1-ylboronic acid pinacol ester,trans-1-oct-1-en-1-yl boronic acid, pinacol ester,trans-4,4,5,5-tetramethyl-2-oct-1-en-1-yl-1,3,2-dioxaborolane PubChem CID: 5706555 IUPAC Name: 4,4,5,5-tetramethyl-2-[(E)-oct-1-enyl]-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C=CCCCCCC
| PubChem CID | 5706555 |
|---|---|
| CAS | 83947-55-1 |
| Molecular Weight (g/mol) | 238.178 |
| MDL Number | MFCD03453667 |
| SMILES | B1(OC(C(O1)(C)C)(C)C)C=CCCCCCC |
| Synonym | trans-4,4,5,5-tetramethyl-2-oct-1-enyl-1,3,2-dioxaborolane,1-octenylboronic acid pinacol ester,1-octen-1-ylboronic acid, pinacol ester,trans-1-octenylboronic acid pinacol ester,trans-4,4,5,5-tetramethyl-2-1-octenyl-1,3,2-dioxaborolane,e-1-octenylboronic acid pinacol ester,trans-1-octen-1-ylboronic acid pinacol ester,trans-1-oct-1-en-1-yl boronic acid, pinacol ester,trans-4,4,5,5-tetramethyl-2-oct-1-en-1-yl-1,3,2-dioxaborolane |
| IUPAC Name | 4,4,5,5-tetramethyl-2-[(E)-oct-1-enyl]-1,3,2-dioxaborolane |
| InChI Key | KQTOSGTXAFJZSJ-VAWYXSNFSA-N |
| Molecular Formula | C14H27BO2 |
Iodoacetamide, 99.41%, MP Biomedicals™
CAS: 144-48-9 Molecular Formula: C2H4INO Molecular Weight (g/mol): 184.964 MDL Number: MFCD00008028 InChI Key: PGLTVOMIXTUURA-UHFFFAOYSA-N Synonym: iodoacetamide,monoiodoacetamide,surauto,acetamide, 2-iodo,2-iodo-acetamide,usaf d-1,alpha-iodoacetamide,ccris 7710,unii-zrh8m27s79,n-3-methoxy-4-butoxybenzyl thiobarbituric acid PubChem CID: 3727 IUPAC Name: 2-iodoacetamide SMILES: C(C(=O)N)I
| PubChem CID | 3727 |
|---|---|
| CAS | 144-48-9 |
| Molecular Weight (g/mol) | 184.964 |
| MDL Number | MFCD00008028 |
| SMILES | C(C(=O)N)I |
| Synonym | iodoacetamide,monoiodoacetamide,surauto,acetamide, 2-iodo,2-iodo-acetamide,usaf d-1,alpha-iodoacetamide,ccris 7710,unii-zrh8m27s79,n-3-methoxy-4-butoxybenzyl thiobarbituric acid |
| IUPAC Name | 2-iodoacetamide |
| InChI Key | PGLTVOMIXTUURA-UHFFFAOYSA-N |
| Molecular Formula | C2H4INO |