Organic acids and derivatives
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3-Tolylboronic acid, 97%
CAS: 17933-03-8 Molecular Formula: C7H9BO2 Molecular Weight (g/mol): 135.96 MDL Number: MFCD00040198 InChI Key: BJQCPCFFYBKRLM-UHFFFAOYSA-N Synonym: 3-tolylboronic acid,m-tolylboronic acid,3-methylphenyl boronic acid,3-methylbenzeneboronic acid,3-methyl phenyl boronic acid,3-tolyboronic acid,3-methylphenyl boranediol,m-methylphenylboronic acid,m-tolyl boronic acid PubChem CID: 2733950 IUPAC Name: (3-methylphenyl)boronic acid SMILES: CC1=CC=CC(=C1)B(O)O
| PubChem CID | 2733950 |
|---|---|
| CAS | 17933-03-8 |
| Molecular Weight (g/mol) | 135.96 |
| MDL Number | MFCD00040198 |
| SMILES | CC1=CC=CC(=C1)B(O)O |
| Synonym | 3-tolylboronic acid,m-tolylboronic acid,3-methylphenyl boronic acid,3-methylbenzeneboronic acid,3-methyl phenyl boronic acid,3-tolyboronic acid,3-methylphenyl boranediol,m-methylphenylboronic acid,m-tolyl boronic acid |
| IUPAC Name | (3-methylphenyl)boronic acid |
| InChI Key | BJQCPCFFYBKRLM-UHFFFAOYSA-N |
| Molecular Formula | C7H9BO2 |
Sodium oxalate, For ACS analysis, 99.96%, MP Biomedicals™
CAS: 62-76-0 Molecular Formula: C2Na2O4 Molecular Weight (g/mol): 134 MDL Number: MFCD00012465 InChI Key: ZNCPFRVNHGOPAG-UHFFFAOYSA-L Synonym: sodium oxalate,disodium oxalate,natriumoxalat,ethanedioic acid, disodium salt,oxalic acid, disodium salt,natriumoxalat german,stavelan sodny czech,oxalic acid disodium salt,unii-7u0v68lt9x,ethanedioic acid disodium salt PubChem CID: 6125 IUPAC Name: disodium oxalate SMILES: [Na+].[Na+].[O-]C(=O)C([O-])=O
| PubChem CID | 6125 |
|---|---|
| CAS | 62-76-0 |
| Molecular Weight (g/mol) | 134 |
| MDL Number | MFCD00012465 |
| SMILES | [Na+].[Na+].[O-]C(=O)C([O-])=O |
| Synonym | sodium oxalate,disodium oxalate,natriumoxalat,ethanedioic acid, disodium salt,oxalic acid, disodium salt,natriumoxalat german,stavelan sodny czech,oxalic acid disodium salt,unii-7u0v68lt9x,ethanedioic acid disodium salt |
| IUPAC Name | disodium oxalate |
| InChI Key | ZNCPFRVNHGOPAG-UHFFFAOYSA-L |
| Molecular Formula | C2Na2O4 |
Methyl 3-[3-(dimethylamino)propoxy]benzoate, 97%, Thermo Scientific™
CAS: 921938-75-2 Molecular Formula: C13H19NO3 Molecular Weight (g/mol): 237.299 MDL Number: MFCD09702393 InChI Key: WGAZXKVAWOAUOI-UHFFFAOYSA-N Synonym: methyl 3-3-dimethylamino propoxy benzoate PubChem CID: 24229605 IUPAC Name: methyl 3-[3-(dimethylamino)propoxy]benzoate SMILES: CN(C)CCCOC1=CC=CC(=C1)C(=O)OC
| PubChem CID | 24229605 |
|---|---|
| CAS | 921938-75-2 |
| Molecular Weight (g/mol) | 237.299 |
| MDL Number | MFCD09702393 |
| SMILES | CN(C)CCCOC1=CC=CC(=C1)C(=O)OC |
| Synonym | methyl 3-3-dimethylamino propoxy benzoate |
| IUPAC Name | methyl 3-[3-(dimethylamino)propoxy]benzoate |
| InChI Key | WGAZXKVAWOAUOI-UHFFFAOYSA-N |
| Molecular Formula | C13H19NO3 |
1-Cyclopropyl-1H-pyrazole-4-boronic acid pinacol ester, 97%
CAS: 1151802-22-0 Molecular Formula: C12H19BN2O2 Molecular Weight (g/mol): 234.106 MDL Number: MFCD16659007 InChI Key: NLWYVKHISUTBMY-UHFFFAOYSA-N Synonym: 1-cyclopropyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,1-cyclopropyl-1h-pyrazole-4-boronic acid pinacol ester,1-cyclopropyl-4-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,1-cyclopropyl-4-4,4,5,5-tetramethyl-1,3,2-di...,1-cyclopropyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole,1-cyclopropyl-4-pinacolylboronate-pyrazole,1-cyclopropy-1-yl-boronic acid pinacol ester,1-cyclopropyl 1h-pyrazole-4-boronic acid pinacol ester,1h-pyrazole,1-cyclopropyl-4-4,4,5,5-tetramethyl-1,1-cyclopropyl-1h-pyrazol-4-yl boronic acid pinacol ester PubChem CID: 59327133 IUPAC Name: 1-cyclopropyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)C3CC3
| PubChem CID | 59327133 |
|---|---|
| CAS | 1151802-22-0 |
| Molecular Weight (g/mol) | 234.106 |
| MDL Number | MFCD16659007 |
| SMILES | B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)C3CC3 |
| Synonym | 1-cyclopropyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,1-cyclopropyl-1h-pyrazole-4-boronic acid pinacol ester,1-cyclopropyl-4-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,1-cyclopropyl-4-4,4,5,5-tetramethyl-1,3,2-di...,1-cyclopropyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole,1-cyclopropyl-4-pinacolylboronate-pyrazole,1-cyclopropy-1-yl-boronic acid pinacol ester,1-cyclopropyl 1h-pyrazole-4-boronic acid pinacol ester,1h-pyrazole,1-cyclopropyl-4-4,4,5,5-tetramethyl-1,1-cyclopropyl-1h-pyrazol-4-yl boronic acid pinacol ester |
| IUPAC Name | 1-cyclopropyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole |
| InChI Key | NLWYVKHISUTBMY-UHFFFAOYSA-N |
| Molecular Formula | C12H19BN2O2 |
3-Aminopropane-1-sulfonic acid, 97%
CAS: 3687-18-1 Molecular Formula: C3H9NO3S Molecular Weight (g/mol): 139.17 MDL Number: MFCD00008225 InChI Key: SNKZJIOFVMKAOJ-UHFFFAOYSA-N Synonym: homotaurine,3-amino-1-propanesulfonic acid,tramiprosate,alzhemed,3-aminopropanesulphonic acid,3aps,1-propanesulfonic acid, 3-amino,cerebril,3-aminopropanesulfonic acid,3-aminopropane sulfonic acid PubChem CID: 1646 ChEBI: CHEBI:1457 IUPAC Name: 3-aminopropane-1-sulfonic acid SMILES: NCCCS(O)(=O)=O
| PubChem CID | 1646 |
|---|---|
| CAS | 3687-18-1 |
| Molecular Weight (g/mol) | 139.17 |
| ChEBI | CHEBI:1457 |
| MDL Number | MFCD00008225 |
| SMILES | NCCCS(O)(=O)=O |
| Synonym | homotaurine,3-amino-1-propanesulfonic acid,tramiprosate,alzhemed,3-aminopropanesulphonic acid,3aps,1-propanesulfonic acid, 3-amino,cerebril,3-aminopropanesulfonic acid,3-aminopropane sulfonic acid |
| IUPAC Name | 3-aminopropane-1-sulfonic acid |
| InChI Key | SNKZJIOFVMKAOJ-UHFFFAOYSA-N |
| Molecular Formula | C3H9NO3S |
Sodium 4-hydroxybenzoate, 99+%
CAS: 114-63-6 Molecular Formula: C7H5NaO3 Molecular Weight (g/mol): 160.10 MDL Number: MFCD00016530 InChI Key: ZLVSYODPTJZFMK-UHFFFAOYSA-M Synonym: sodium 4-hydroxybenzoate,sodium p-hydroxybenzoate,4-hydroxybenzoic acid sodium salt,sodium paraben,benzoic acid, 4-hydroxy-, monosodium salt,p-hydroxybenzoic acid sodium salt,monosodium p-hydroxybenzoate,monosodium 4-hydroxybenzoate,benzoic acid, p-hydroxy-, sodium salt,benzoic acid, 4-hydroxy-, sodium salt 1:1 PubChem CID: 16219477 SMILES: [Na+].OC1=CC=C(C=C1)C([O-])=O
| PubChem CID | 16219477 |
|---|---|
| CAS | 114-63-6 |
| Molecular Weight (g/mol) | 160.10 |
| MDL Number | MFCD00016530 |
| SMILES | [Na+].OC1=CC=C(C=C1)C([O-])=O |
| Synonym | sodium 4-hydroxybenzoate,sodium p-hydroxybenzoate,4-hydroxybenzoic acid sodium salt,sodium paraben,benzoic acid, 4-hydroxy-, monosodium salt,p-hydroxybenzoic acid sodium salt,monosodium p-hydroxybenzoate,monosodium 4-hydroxybenzoate,benzoic acid, p-hydroxy-, sodium salt,benzoic acid, 4-hydroxy-, sodium salt 1:1 |
| InChI Key | ZLVSYODPTJZFMK-UHFFFAOYSA-M |
| Molecular Formula | C7H5NaO3 |
3-Chloro-4-cyanobenzeneboronic acid, 96%
CAS: 1008415-02-8 Molecular Formula: C7H5BClNO2 Molecular Weight (g/mol): 181.382 InChI Key: QCJTUOIMDNJEHR-UHFFFAOYSA-N Synonym: 3-chloro-4-cyanophenyl boronic acid,boronic acid, b-3-chloro-4-cyanophenyl,acmc-2097sr,3-chloro-4-cyanophenyl boronicacid PubChem CID: 46738932 IUPAC Name: (3-chloro-4-cyanophenyl)boronic acid SMILES: B(C1=CC(=C(C=C1)C#N)Cl)(O)O
| PubChem CID | 46738932 |
|---|---|
| CAS | 1008415-02-8 |
| Molecular Weight (g/mol) | 181.382 |
| SMILES | B(C1=CC(=C(C=C1)C#N)Cl)(O)O |
| Synonym | 3-chloro-4-cyanophenyl boronic acid,boronic acid, b-3-chloro-4-cyanophenyl,acmc-2097sr,3-chloro-4-cyanophenyl boronicacid |
| IUPAC Name | (3-chloro-4-cyanophenyl)boronic acid |
| InChI Key | QCJTUOIMDNJEHR-UHFFFAOYSA-N |
| Molecular Formula | C7H5BClNO2 |
2-Cyano-3-methoxybenzeneboronic acid, 95%
CAS: 1164100-84-8 Molecular Formula: C8H8BNO3 Molecular Weight (g/mol): 176.97 MDL Number: MFCD10696671 InChI Key: GRHINHWGIHWEPE-UHFFFAOYSA-N Synonym: 2-cyano-3-methoxyphenyl boronic acid,acmc-2099sp,2-cyano-3-methoxyphenyl boronicacid PubChem CID: 53216734 IUPAC Name: (2-cyano-3-methoxyphenyl)boronic acid SMILES: COC1=CC=CC(B(O)O)=C1C#N
| PubChem CID | 53216734 |
|---|---|
| CAS | 1164100-84-8 |
| Molecular Weight (g/mol) | 176.97 |
| MDL Number | MFCD10696671 |
| SMILES | COC1=CC=CC(B(O)O)=C1C#N |
| Synonym | 2-cyano-3-methoxyphenyl boronic acid,acmc-2099sp,2-cyano-3-methoxyphenyl boronicacid |
| IUPAC Name | (2-cyano-3-methoxyphenyl)boronic acid |
| InChI Key | GRHINHWGIHWEPE-UHFFFAOYSA-N |
| Molecular Formula | C8H8BNO3 |
4-Nitrophenylboronic acid, 97%
CAS: 24067-17-2 Molecular Formula: C6H6BNO4 Molecular Weight (g/mol): 166.93 MDL Number: MFCD00161360 InChI Key: NSFJAFZHYOAMHL-UHFFFAOYSA-N Synonym: 4-nitrophenyl boronic acid,4-nitrobenzeneboronic acid,p-nitrophenylboronic acid,4-nitrophenylboronicacid,p-nitrophenyl boronic acid,4-nitro phenyl boronic acid,boronic acid, 4-nitrophenyl,boronic acid, b-4-nitrophenyl,4-borononitrobenzene PubChem CID: 2773552 IUPAC Name: (4-nitrophenyl)boronic acid SMILES: OB(O)C1=CC=C(C=C1)[N+]([O-])=O
| PubChem CID | 2773552 |
|---|---|
| CAS | 24067-17-2 |
| Molecular Weight (g/mol) | 166.93 |
| MDL Number | MFCD00161360 |
| SMILES | OB(O)C1=CC=C(C=C1)[N+]([O-])=O |
| Synonym | 4-nitrophenyl boronic acid,4-nitrobenzeneboronic acid,p-nitrophenylboronic acid,4-nitrophenylboronicacid,p-nitrophenyl boronic acid,4-nitro phenyl boronic acid,boronic acid, 4-nitrophenyl,boronic acid, b-4-nitrophenyl,4-borononitrobenzene |
| IUPAC Name | (4-nitrophenyl)boronic acid |
| InChI Key | NSFJAFZHYOAMHL-UHFFFAOYSA-N |
| Molecular Formula | C6H6BNO4 |
5-Fluoropyridine-3-boronic acid, 98%
CAS: 872041-86-6 Molecular Formula: C5H5BFNO2 Molecular Weight (g/mol): 140.908 MDL Number: MFCD07368243 InChI Key: FVEDGBRHTGXPOK-UHFFFAOYSA-N Synonym: 5-fluoropyridine-3-boronic acid,5-fluoropyridin-3-yl boronic acid,5-fluoropyridin-3-yl-3-boronic acid,5-fluoropyridine-3-boronicacid,5-fluoro-3-pyridylboronic acid,3-fluoropyridine-5-boronic acid,5-fluoro-3-pyridyl boronic acid,acmc-209qir,boric acid fluoride-3-5,3-borono-5-fluoropyridine PubChem CID: 44717403 IUPAC Name: (5-fluoropyridin-3-yl)boronic acid SMILES: B(C1=CC(=CN=C1)F)(O)O
| PubChem CID | 44717403 |
|---|---|
| CAS | 872041-86-6 |
| Molecular Weight (g/mol) | 140.908 |
| MDL Number | MFCD07368243 |
| SMILES | B(C1=CC(=CN=C1)F)(O)O |
| Synonym | 5-fluoropyridine-3-boronic acid,5-fluoropyridin-3-yl boronic acid,5-fluoropyridin-3-yl-3-boronic acid,5-fluoropyridine-3-boronicacid,5-fluoro-3-pyridylboronic acid,3-fluoropyridine-5-boronic acid,5-fluoro-3-pyridyl boronic acid,acmc-209qir,boric acid fluoride-3-5,3-borono-5-fluoropyridine |
| IUPAC Name | (5-fluoropyridin-3-yl)boronic acid |
| InChI Key | FVEDGBRHTGXPOK-UHFFFAOYSA-N |
| Molecular Formula | C5H5BFNO2 |
3-Butynyl p-toluenesulfonate, 96%
CAS: 23418-85-1 Molecular Formula: C11H12O3S Molecular Weight (g/mol): 224.274 MDL Number: MFCD00041687 InChI Key: STOASOOVVADOKH-UHFFFAOYSA-N Synonym: 3-butynyl p-toluenesulfonate,but-3-yn-1-yl 4-methylbenzenesulfonate,3-butynyl tosylate,3-butynyl 4-toluenesulfonate,3-1-butynyl-4-toluenesulphonate,3-butynyl 4-methylbenzenesulfonate,p-toluenesulfonic acid 3-butynyl ester,but-3-ynyl tosylate,4-tosyloxy-1-butyne,acmc-1cgfq PubChem CID: 272020 IUPAC Name: but-3-ynyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCC#C
| PubChem CID | 272020 |
|---|---|
| CAS | 23418-85-1 |
| Molecular Weight (g/mol) | 224.274 |
| MDL Number | MFCD00041687 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCCC#C |
| Synonym | 3-butynyl p-toluenesulfonate,but-3-yn-1-yl 4-methylbenzenesulfonate,3-butynyl tosylate,3-butynyl 4-toluenesulfonate,3-1-butynyl-4-toluenesulphonate,3-butynyl 4-methylbenzenesulfonate,p-toluenesulfonic acid 3-butynyl ester,but-3-ynyl tosylate,4-tosyloxy-1-butyne,acmc-1cgfq |
| IUPAC Name | but-3-ynyl 4-methylbenzenesulfonate |
| InChI Key | STOASOOVVADOKH-UHFFFAOYSA-N |
| Molecular Formula | C11H12O3S |
2-Aminoethyl methacrylate hydrochloride, 90%, stabilized
CAS: 2420-94-2 Molecular Formula: C6H11NO2·HCl Molecular Weight (g/mol): 165.62 MDL Number: MFCD00078260 InChI Key: XSHISXQEKIKSGC-UHFFFAOYSA-N Synonym: 2-aminoethyl methacrylate hydrochloride,2-aminoethylmethacrylate hydrochloride,2-aminoethyl 2-methylacrylate hydrochloride,methacrylic acid, 2-aminoethyl ester, hydrochloride, polymers,2-aminoethyl 2-methylprop-2-enoate hydrochloride,2-propenoic acid, 2-methyl-, 2-aminoethyl ester, hydrochloride 1:1,2-propenoic acid, 2-methyl-, 2-aminoethyl ester, hydrochloride,aminoethylmethacrylate,acmc-209wgm,timtec-bb sbb003905 PubChem CID: 75495 IUPAC Name: 2-aminoethyl 2-methylprop-2-enoate;hydrochloride SMILES: CC(=C)C(=O)OCCN.Cl
| PubChem CID | 75495 |
|---|---|
| CAS | 2420-94-2 |
| Molecular Weight (g/mol) | 165.62 |
| MDL Number | MFCD00078260 |
| SMILES | CC(=C)C(=O)OCCN.Cl |
| Synonym | 2-aminoethyl methacrylate hydrochloride,2-aminoethylmethacrylate hydrochloride,2-aminoethyl 2-methylacrylate hydrochloride,methacrylic acid, 2-aminoethyl ester, hydrochloride, polymers,2-aminoethyl 2-methylprop-2-enoate hydrochloride,2-propenoic acid, 2-methyl-, 2-aminoethyl ester, hydrochloride 1:1,2-propenoic acid, 2-methyl-, 2-aminoethyl ester, hydrochloride,aminoethylmethacrylate,acmc-209wgm,timtec-bb sbb003905 |
| IUPAC Name | 2-aminoethyl 2-methylprop-2-enoate;hydrochloride |
| InChI Key | XSHISXQEKIKSGC-UHFFFAOYSA-N |
| Molecular Formula | C6H11NO2·HCl |
Sodium Benzoate, Powder, FCC, 99-101%, Spectrum™ Chemical
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CAS: 532-32-1 Molecular Formula: C7H5NaO2 Molecular Weight (g/mol): 144.11 MDL Number: MFCD00012463 InChI Key: WXMKPNITSTVMEF-UHFFFAOYSA-M IUPAC Name: sodium benzoate SMILES: [Na+].[O-]C(=O)C1=CC=CC=C1
| CAS | 532-32-1 |
|---|---|
| Molecular Weight (g/mol) | 144.11 |
| MDL Number | MFCD00012463 |
| SMILES | [Na+].[O-]C(=O)C1=CC=CC=C1 |
| IUPAC Name | sodium benzoate |
| InChI Key | WXMKPNITSTVMEF-UHFFFAOYSA-M |
| Molecular Formula | C7H5NaO2 |
Sodium 1-Hexanesulfonate Monohydrate, 99%
CAS: 207300-91-2 Molecular Formula: C6H15NaO4S Molecular Weight (g/mol): 206.232 MDL Number: MFCD00149549 InChI Key: CLCGFJYKZGFGSQ-UHFFFAOYSA-M Synonym: 1-hexanesulfonic acid sodium salt monohydrate,sodium hexane-1-sulfonate hydrate,sodium 1-hexanesulfonate monohydrate,n-1-hexanesulfonic acid,sodium 1-hexanesulfonate hydrate,sodium n-hexanesulfonate monohydrate,potassium hexane-1-sulfonate hydrate,sodium hexane-1-sulphonate monohydrate,sodium hexane-1-sulfonate-water 1/1/1,1-hexanesulfonic acid,sodium salt, hydrate 1:1:1 PubChem CID: 23696962 IUPAC Name: sodium;hexane-1-sulfonate;hydrate SMILES: CCCCCCS(=O)(=O)[O-].O.[Na+]
| PubChem CID | 23696962 |
|---|---|
| CAS | 207300-91-2 |
| Molecular Weight (g/mol) | 206.232 |
| MDL Number | MFCD00149549 |
| SMILES | CCCCCCS(=O)(=O)[O-].O.[Na+] |
| Synonym | 1-hexanesulfonic acid sodium salt monohydrate,sodium hexane-1-sulfonate hydrate,sodium 1-hexanesulfonate monohydrate,n-1-hexanesulfonic acid,sodium 1-hexanesulfonate hydrate,sodium n-hexanesulfonate monohydrate,potassium hexane-1-sulfonate hydrate,sodium hexane-1-sulphonate monohydrate,sodium hexane-1-sulfonate-water 1/1/1,1-hexanesulfonic acid,sodium salt, hydrate 1:1:1 |
| IUPAC Name | sodium;hexane-1-sulfonate;hydrate |
| InChI Key | CLCGFJYKZGFGSQ-UHFFFAOYSA-M |
| Molecular Formula | C6H15NaO4S |