Organic acids and derivatives
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Biphenyl-2-boronic acid, 95%
CAS: 4688-76-0 Molecular Formula: C12H11BO2 Molecular Weight (g/mol): 198.028 MDL Number: MFCD00136929 InChI Key: HYCYKHYFIWHGEX-UHFFFAOYSA-N Synonym: 2-biphenylboronic acid,biphenyl-2-boronic acid,biphenyl-2-ylboronic acid,2-biphenylboronicacid,2-phenylphenyl boranediol,2-phenylphenyl boronic acid,1,1'-biphenyl-2-ylboronic acid,2-biphenylylboronic acid,1,1'-biphenylboronic acid,2-phenylbenzeneboronic acid PubChem CID: 4589187 IUPAC Name: (2-phenylphenyl)boronic acid SMILES: B(C1=CC=CC=C1C2=CC=CC=C2)(O)O
| PubChem CID | 4589187 |
|---|---|
| CAS | 4688-76-0 |
| Molecular Weight (g/mol) | 198.028 |
| MDL Number | MFCD00136929 |
| SMILES | B(C1=CC=CC=C1C2=CC=CC=C2)(O)O |
| Synonym | 2-biphenylboronic acid,biphenyl-2-boronic acid,biphenyl-2-ylboronic acid,2-biphenylboronicacid,2-phenylphenyl boranediol,2-phenylphenyl boronic acid,1,1'-biphenyl-2-ylboronic acid,2-biphenylylboronic acid,1,1'-biphenylboronic acid,2-phenylbenzeneboronic acid |
| IUPAC Name | (2-phenylphenyl)boronic acid |
| InChI Key | HYCYKHYFIWHGEX-UHFFFAOYSA-N |
| Molecular Formula | C12H11BO2 |
N,N-Dimethylformamide di-tert-butyl acetal, ≥90.0%, MilliporeSigma™ Supelco™
MDL Number: MFCD00015002 Synonym: 1,1-Di-tert-butoxy-N,N-dimethylmethylamine; 1,1-Di-tert-butoxytrimethylamine
| MDL Number | MFCD00015002 |
|---|---|
| Synonym | 1,1-Di-tert-butoxy-N,N-dimethylmethylamine; 1,1-Di-tert-butoxytrimethylamine |
1-Hexanesulfonic Acid Sodium Salt, Monohydrate, 98%, Spectrum™ Chemical
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CAS: 207300-91-2
| CAS | 207300-91-2 |
|---|
N,N-Dimethylbutyramide, 98%
CAS: 760-79-2 Molecular Formula: C6H13NO Molecular Weight (g/mol): 115.176 MDL Number: MFCD00015222 InChI Key: VIJUZNJJLALGNJ-UHFFFAOYSA-N Synonym: n,n-dimethylbutyramide,butanamide, n,n-dimethyl,n,n-dimethyl-n-butyramide,nn-dimethylbutyramide,butyramide, n,n-dimethyl,butanamide,n-dimethyl,butanamide,n,n-dimethyl,butanoic acid dimethylamide,nn-dimethylbutyramide, pract.,wln: 3vn1&1 PubChem CID: 12973 IUPAC Name: N,N-dimethylbutanamide SMILES: CCCC(=O)N(C)C
| PubChem CID | 12973 |
|---|---|
| CAS | 760-79-2 |
| Molecular Weight (g/mol) | 115.176 |
| MDL Number | MFCD00015222 |
| SMILES | CCCC(=O)N(C)C |
| Synonym | n,n-dimethylbutyramide,butanamide, n,n-dimethyl,n,n-dimethyl-n-butyramide,nn-dimethylbutyramide,butyramide, n,n-dimethyl,butanamide,n-dimethyl,butanamide,n,n-dimethyl,butanoic acid dimethylamide,nn-dimethylbutyramide, pract.,wln: 3vn1&1 |
| IUPAC Name | N,N-dimethylbutanamide |
| InChI Key | VIJUZNJJLALGNJ-UHFFFAOYSA-N |
| Molecular Formula | C6H13NO |
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 |
Phytosterols, Practical Grade, MP Biomedicals™
CAS: 83-46-5 Molecular Formula: C29H50O Molecular Weight (g/mol): 414.718 InChI Key: KZJWDPNRJALLNS-VJSFXXLFSA-N Synonym: 22,23-dihydrostigmasterol,α-Dihydrofucosterol,24β-Ethylcholesterol,5-Stigmasten-3β-ol,22,23-dihydrostigmasterol,azuprostat,triastonal,cinchol,rhamnol,harzol PubChem CID: 222284 ChEBI: CHEBI:27693 IUPAC Name: (3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol SMILES: CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
| PubChem CID | 222284 |
|---|---|
| CAS | 83-46-5 |
| Molecular Weight (g/mol) | 414.718 |
| ChEBI | CHEBI:27693 |
| SMILES | CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C |
| Synonym | 22,23-dihydrostigmasterol,α-Dihydrofucosterol,24β-Ethylcholesterol,5-Stigmasten-3β-ol,22,23-dihydrostigmasterol,azuprostat,triastonal,cinchol,rhamnol,harzol |
| IUPAC Name | (3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| InChI Key | KZJWDPNRJALLNS-VJSFXXLFSA-N |
| Molecular Formula | C29H50O |
Methanesulfonic anhydride, 97%
CAS: 7143-01-3 Molecular Formula: C2H6O5S2 Molecular Weight (g/mol): 174.19 MDL Number: MFCD00007556 InChI Key: IZDROVVXIHRYMH-UHFFFAOYSA-N Synonym: methanesulfonic anhydride,methanesulfonic acid, anhydride,mesyl anhydride,mesic anhydride,methanesulphonic anhydride,methane sulfonic acid anhydride,methanesulfonyl methanesulfonate,methane sulfonic anhydride,methanesulfonic acid, 1,1'-anhydride,methanesulfonic acid methylsulfonyl ester PubChem CID: 81560 IUPAC Name: methylsulfonyl methanesulfonate SMILES: CS(=O)(=O)OS(=O)(=O)C
| PubChem CID | 81560 |
|---|---|
| CAS | 7143-01-3 |
| Molecular Weight (g/mol) | 174.19 |
| MDL Number | MFCD00007556 |
| SMILES | CS(=O)(=O)OS(=O)(=O)C |
| Synonym | methanesulfonic anhydride,methanesulfonic acid, anhydride,mesyl anhydride,mesic anhydride,methanesulphonic anhydride,methane sulfonic acid anhydride,methanesulfonyl methanesulfonate,methane sulfonic anhydride,methanesulfonic acid, 1,1'-anhydride,methanesulfonic acid methylsulfonyl ester |
| IUPAC Name | methylsulfonyl methanesulfonate |
| InChI Key | IZDROVVXIHRYMH-UHFFFAOYSA-N |
| Molecular Formula | C2H6O5S2 |
Ethyl 4-pyrazolecarboxylate, 98%, Thermo Scientific™
CAS: 37622-90-5 Molecular Formula: C6H8N2O2 Molecular Weight (g/mol): 140.14 MDL Number: MFCD00010844 InChI Key: KACZQOKEFKFNDB-UHFFFAOYSA-N Synonym: ethyl 4-pyrazolecarboxylate,ethyl pyrazole-4-carboxylate,1h-pyrazole-4-carboxylic acid ethyl ester,4-ethoxycarbonylpyrazole,1h-pyrazole-4-carboxylic acid, ethyl ester,4-pyrazolecarboxylic acid ethyl ester,ethyl4-pyrazolecarboxylate,zlchem 132,pubchem21939,acmc-209iug PubChem CID: 142179 IUPAC Name: ethyl 1H-pyrazole-4-carboxylate SMILES: CCOC(=O)C1=CNN=C1
| PubChem CID | 142179 |
|---|---|
| CAS | 37622-90-5 |
| Molecular Weight (g/mol) | 140.14 |
| MDL Number | MFCD00010844 |
| SMILES | CCOC(=O)C1=CNN=C1 |
| Synonym | ethyl 4-pyrazolecarboxylate,ethyl pyrazole-4-carboxylate,1h-pyrazole-4-carboxylic acid ethyl ester,4-ethoxycarbonylpyrazole,1h-pyrazole-4-carboxylic acid, ethyl ester,4-pyrazolecarboxylic acid ethyl ester,ethyl4-pyrazolecarboxylate,zlchem 132,pubchem21939,acmc-209iug |
| IUPAC Name | ethyl 1H-pyrazole-4-carboxylate |
| InChI Key | KACZQOKEFKFNDB-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O2 |
mono-n-Dodecyl phosphate, tech. 90%
CAS: 2627-35-2 Molecular Formula: C12H27O4P Molecular Weight (g/mol): 266.32 MDL Number: MFCD00013946 InChI Key: TVACALAUIQMRDF-UHFFFAOYSA-N Synonym: dodecyl phosphate,monolauryl phosphate,phosphoric acid, monododecyl ester,mono-n-dodecyl phosphate,monododecyl phosphate,dihydrogen monolauryl phosphate,lauryl dihydrogen phosphate,unii-0k08l8ge2h,phosphoric acid monododecyl ester,dodecyloxyphosphonic acid PubChem CID: 75816 IUPAC Name: dodecyl dihydrogen phosphate SMILES: CCCCCCCCCCCCOP(O)(O)=O
| PubChem CID | 75816 |
|---|---|
| CAS | 2627-35-2 |
| Molecular Weight (g/mol) | 266.32 |
| MDL Number | MFCD00013946 |
| SMILES | CCCCCCCCCCCCOP(O)(O)=O |
| Synonym | dodecyl phosphate,monolauryl phosphate,phosphoric acid, monododecyl ester,mono-n-dodecyl phosphate,monododecyl phosphate,dihydrogen monolauryl phosphate,lauryl dihydrogen phosphate,unii-0k08l8ge2h,phosphoric acid monododecyl ester,dodecyloxyphosphonic acid |
| IUPAC Name | dodecyl dihydrogen phosphate |
| InChI Key | TVACALAUIQMRDF-UHFFFAOYSA-N |
| Molecular Formula | C12H27O4P |
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 |
Ethyl pyrrole-2-carboxylate, 98+%
CAS: 2199-43-1 Molecular Formula: C7H9NO2 Molecular Weight (g/mol): 139.154 MDL Number: MFCD00817049 InChI Key: PAEYAKGINDQUCT-UHFFFAOYSA-N Synonym: ethyl pyrrole-2-carboxylate,ethyl 2-pyrrolecarboxylate,ethyl pyrrole-2-carbonate,ethylpyrrole-2-carboxylate,1h-pyrrole-2-carboxylic acid, ethyl ester,2-ethoxycarbonyl-1h-pyrrole,pyrrole-2-carboxylic acid, ethyl ester,1h-pyrrole-2-carboxylic acid ethyl ester,pyrrole-2-carboxylic acid ethyl ester,ethyl1h-pyrrole-2-carboxylate PubChem CID: 255670 IUPAC Name: ethyl 1H-pyrrole-2-carboxylate SMILES: CCOC(=O)C1=CC=CN1
| PubChem CID | 255670 |
|---|---|
| CAS | 2199-43-1 |
| Molecular Weight (g/mol) | 139.154 |
| MDL Number | MFCD00817049 |
| SMILES | CCOC(=O)C1=CC=CN1 |
| Synonym | ethyl pyrrole-2-carboxylate,ethyl 2-pyrrolecarboxylate,ethyl pyrrole-2-carbonate,ethylpyrrole-2-carboxylate,1h-pyrrole-2-carboxylic acid, ethyl ester,2-ethoxycarbonyl-1h-pyrrole,pyrrole-2-carboxylic acid, ethyl ester,1h-pyrrole-2-carboxylic acid ethyl ester,pyrrole-2-carboxylic acid ethyl ester,ethyl1h-pyrrole-2-carboxylate |
| IUPAC Name | ethyl 1H-pyrrole-2-carboxylate |
| InChI Key | PAEYAKGINDQUCT-UHFFFAOYSA-N |
| Molecular Formula | C7H9NO2 |
1-Naphthyl phosphate disodium salt hydrate, 99%
CAS: 207569-06-0 Molecular Formula: C10H7Na2O4P Molecular Weight (g/mol): 268.12 MDL Number: MFCD00041007 InChI Key: QYURIFWAOPAPAJ-UHFFFAOYSA-L Synonym: 1-naphthyl phosphate disodium salt hydrate,sodium naphthalen-1-yl phosphate hydrate,disodium 1-naphthyl phosphate hydrate,disodium hydrate naphthalen-1-yl phosphate,1-naphthyl phosphate sodium salt monohydrate,c10h7o4p.2na.h2o,1-naphthyl?phosphate?disodium?salt?hydrate,1-naphthyl phosphate disodium salt monohydrate,dihydrogen naphthyl phosphate, oxamethane, sodium salt, sodium salt PubChem CID: 24212014 IUPAC Name: disodium;naphthalen-1-yl phosphate;hydrate SMILES: [Na+].[Na+].[O-]P([O-])(=O)OC1=C2C=CC=CC2=CC=C1
| PubChem CID | 24212014 |
|---|---|
| CAS | 207569-06-0 |
| Molecular Weight (g/mol) | 268.12 |
| MDL Number | MFCD00041007 |
| SMILES | [Na+].[Na+].[O-]P([O-])(=O)OC1=C2C=CC=CC2=CC=C1 |
| Synonym | 1-naphthyl phosphate disodium salt hydrate,sodium naphthalen-1-yl phosphate hydrate,disodium 1-naphthyl phosphate hydrate,disodium hydrate naphthalen-1-yl phosphate,1-naphthyl phosphate sodium salt monohydrate,c10h7o4p.2na.h2o,1-naphthyl?phosphate?disodium?salt?hydrate,1-naphthyl phosphate disodium salt monohydrate,dihydrogen naphthyl phosphate, oxamethane, sodium salt, sodium salt |
| IUPAC Name | disodium;naphthalen-1-yl phosphate;hydrate |
| InChI Key | QYURIFWAOPAPAJ-UHFFFAOYSA-L |
| Molecular Formula | C10H7Na2O4P |
n-Butyl L-lactate, 97+%
CAS: 34451-19-9 Molecular Formula: C7H14O3 Molecular Weight (g/mol): 146.19 MDL Number: MFCD00004519,MFCD00066454 InChI Key: MRABAEUHTLLEML-UHFFFAOYNA-N PubChem CID: 6999977 IUPAC Name: butyl (2S)-2-hydroxypropanoate SMILES: CCCCOC(=O)C(C)O
| PubChem CID | 6999977 |
|---|---|
| CAS | 34451-19-9 |
| Molecular Weight (g/mol) | 146.19 |
| MDL Number | MFCD00004519,MFCD00066454 |
| SMILES | CCCCOC(=O)C(C)O |
| IUPAC Name | butyl (2S)-2-hydroxypropanoate |
| InChI Key | MRABAEUHTLLEML-UHFFFAOYNA-N |
| Molecular Formula | C7H14O3 |
Methyl cinnamate, predominantly trans, 99%
CAS: 103-26-4 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00008458 InChI Key: CCRCUPLGCSFEDV-BQYQJAHWSA-N Synonym: methyl cinnamate,methyl trans-cinnamate,methyl e-cinnamate,cinnamic acid methyl ester,methyl cinnamylate,methyl 3-phenylacrylate,methyl e-3-phenylprop-2-enoate,methyl 3-phenylpropenoate,trans-cinnamic acid methyl ester,trans-methyl cinnamate PubChem CID: 637520 ChEBI: CHEBI:6857 IUPAC Name: methyl (E)-3-phenylprop-2-enoate SMILES: COC(=O)C=CC1=CC=CC=C1
| PubChem CID | 637520 |
|---|---|
| CAS | 103-26-4 |
| Molecular Weight (g/mol) | 162.188 |
| ChEBI | CHEBI:6857 |
| MDL Number | MFCD00008458 |
| SMILES | COC(=O)C=CC1=CC=CC=C1 |
| Synonym | methyl cinnamate,methyl trans-cinnamate,methyl e-cinnamate,cinnamic acid methyl ester,methyl cinnamylate,methyl 3-phenylacrylate,methyl e-3-phenylprop-2-enoate,methyl 3-phenylpropenoate,trans-cinnamic acid methyl ester,trans-methyl cinnamate |
| IUPAC Name | methyl (E)-3-phenylprop-2-enoate |
| InChI Key | CCRCUPLGCSFEDV-BQYQJAHWSA-N |
| Molecular Formula | C10H10O2 |
Oxindole, 97+%
CAS: 59-48-3 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00005711 InChI Key: JYGFTBXVXVMTGB-UHFFFAOYSA-N Synonym: oxindole,indolin-2-one,2-oxindole,2-indolinone,1,3-dihydro-2h-indol-2-one,oxindol,2-oxoindoline,2-oxindoline,indol-2 3h-one,2h-indol-2-one, 1,3-dihydro PubChem CID: 321710 ChEBI: CHEBI:31697 IUPAC Name: 1,3-dihydroindol-2-one SMILES: C1C2=CC=CC=C2NC1=O
| PubChem CID | 321710 |
|---|---|
| CAS | 59-48-3 |
| Molecular Weight (g/mol) | 133.15 |
| ChEBI | CHEBI:31697 |
| MDL Number | MFCD00005711 |
| SMILES | C1C2=CC=CC=C2NC1=O |
| Synonym | oxindole,indolin-2-one,2-oxindole,2-indolinone,1,3-dihydro-2h-indol-2-one,oxindol,2-oxoindoline,2-oxindoline,indol-2 3h-one,2h-indol-2-one, 1,3-dihydro |
| IUPAC Name | 1,3-dihydroindol-2-one |
| InChI Key | JYGFTBXVXVMTGB-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO |