Organic acids and derivatives
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5-(Methylsulfonyl)pyridine-3-boronic acid, 98%
CAS: 913836-01-8 Molecular Formula: C6H8BNO4S Molecular Weight (g/mol): 201.00 MDL Number: MFCD08689536 InChI Key: YGXNPQDXWDCWET-UHFFFAOYSA-N Synonym: 5-methylsulphonyl pyridine-3-boronic acid,5-methylsulfonyl pyridine-3-boronic acid,5-methylsulfonyl pyridin-3-yl boronic acid,5-methylsulfonyl-3-pyridineboronic acid,boronicacid, b-5-methylsulfonyl-3-pyridinyl,5-methanesulfonylpyridin-3-ylboronic acid,b-5-methylsulfonyl-3-pyridinyl boronic acid,acmc-209ram PubChem CID: 44119381 IUPAC Name: (5-methanesulfonylpyridin-3-yl)boronic acid SMILES: CS(=O)(=O)C1=CN=CC(=C1)B(O)O
| PubChem CID | 44119381 |
|---|---|
| CAS | 913836-01-8 |
| Molecular Weight (g/mol) | 201.00 |
| MDL Number | MFCD08689536 |
| SMILES | CS(=O)(=O)C1=CN=CC(=C1)B(O)O |
| Synonym | 5-methylsulphonyl pyridine-3-boronic acid,5-methylsulfonyl pyridine-3-boronic acid,5-methylsulfonyl pyridin-3-yl boronic acid,5-methylsulfonyl-3-pyridineboronic acid,boronicacid, b-5-methylsulfonyl-3-pyridinyl,5-methanesulfonylpyridin-3-ylboronic acid,b-5-methylsulfonyl-3-pyridinyl boronic acid,acmc-209ram |
| IUPAC Name | (5-methanesulfonylpyridin-3-yl)boronic acid |
| InChI Key | YGXNPQDXWDCWET-UHFFFAOYSA-N |
| Molecular Formula | C6H8BNO4S |
Ethyl difluoroacetate, 98%
CAS: 454-31-9 Molecular Formula: C4H6F2O2 Molecular Weight (g/mol): 124.087 MDL Number: MFCD00013578 InChI Key: GZKHDVAKKLTJPO-UHFFFAOYSA-N Synonym: ethyl difluoroacetate,acetic acid, difluoro-, ethyl ester,difluoroacetic acid ethyl ester,ethyldifluoroacetate,ethyl difluoroacetic,ethyl difluoro acetate,difluoro-acetic acid ethyl ester,ethyl difluoroacetic acid,acetic acid, 2,2-difluoro-, ethyl ester,ethyldifluoracetat PubChem CID: 9961 IUPAC Name: ethyl 2,2-difluoroacetate SMILES: CCOC(=O)C(F)F
| PubChem CID | 9961 |
|---|---|
| CAS | 454-31-9 |
| Molecular Weight (g/mol) | 124.087 |
| MDL Number | MFCD00013578 |
| SMILES | CCOC(=O)C(F)F |
| Synonym | ethyl difluoroacetate,acetic acid, difluoro-, ethyl ester,difluoroacetic acid ethyl ester,ethyldifluoroacetate,ethyl difluoroacetic,ethyl difluoro acetate,difluoro-acetic acid ethyl ester,ethyl difluoroacetic acid,acetic acid, 2,2-difluoro-, ethyl ester,ethyldifluoracetat |
| IUPAC Name | ethyl 2,2-difluoroacetate |
| InChI Key | GZKHDVAKKLTJPO-UHFFFAOYSA-N |
| Molecular Formula | C4H6F2O2 |
Spectrum Chemical Manufacturing Corporation Sodium Ascorbate, FCC, 99-101%, Spectrum™ Chemical
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CAS: 134-03-2 Molecular Formula: C6H7NaO6 Molecular Weight (g/mol): 198.11 InChI Key: IFVCRSPJFHGFCG-HXPAKLQESA-N IUPAC Name: sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide SMILES: [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O
| CAS | 134-03-2 |
|---|---|
| Molecular Weight (g/mol) | 198.11 |
| SMILES | [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O |
| IUPAC Name | sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide |
| InChI Key | IFVCRSPJFHGFCG-HXPAKLQESA-N |
| Molecular Formula | C6H7NaO6 |
Sodium Ascorbate, Powder, USP, 99-101%, Spectrum™ Chemical
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CAS: 134-03-2 Molecular Formula: C6H7NaO6 Molecular Weight (g/mol): 198.11 InChI Key: IFVCRSPJFHGFCG-HXPAKLQESA-N IUPAC Name: sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide SMILES: [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O
| CAS | 134-03-2 |
|---|---|
| Molecular Weight (g/mol) | 198.11 |
| SMILES | [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O |
| IUPAC Name | sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide |
| InChI Key | IFVCRSPJFHGFCG-HXPAKLQESA-N |
| Molecular Formula | C6H7NaO6 |
Potassium Sodium Tartrate, Tetrahydrate, Granular, USP, 99-102%, Spectrum™ Chemical
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CAS: 6381-59-5 Molecular Formula: C4H12KNaO10 Molecular Weight (g/mol): 282.22 InChI Key: VZOPRCCTKLAGPN-ZFJVMAEJSA-L IUPAC Name: potassium sodium (2R,3R)-2,3-dihydroxybutanedioate tetrahydrate SMILES: O.O.O.O.[Na+].[K+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O
| CAS | 6381-59-5 |
|---|---|
| Molecular Weight (g/mol) | 282.22 |
| SMILES | O.O.O.O.[Na+].[K+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O |
| IUPAC Name | potassium sodium (2R,3R)-2,3-dihydroxybutanedioate tetrahydrate |
| InChI Key | VZOPRCCTKLAGPN-ZFJVMAEJSA-L |
| Molecular Formula | C4H12KNaO10 |
Propionic Acid, FCC, 99.5-100.5%, Spectrum™ Chemical
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CAS: 79-09-4 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.08 InChI Key: XBDQKXXYIPTUBI-UHFFFAOYSA-N IUPAC Name: propanoic acid SMILES: CCC(O)=O
| CAS | 79-09-4 |
|---|---|
| Molecular Weight (g/mol) | 74.08 |
| SMILES | CCC(O)=O |
| IUPAC Name | propanoic acid |
| InChI Key | XBDQKXXYIPTUBI-UHFFFAOYSA-N |
| Molecular Formula | C3H6O2 |
1-Benzothiophene-7-carboxylic acid, 97%, Thermo Scientific™
CAS: 10134-98-2 Molecular Formula: C9H6O2S Molecular Weight (g/mol): 178.205 InChI Key: LJPSRTWIAXVPIS-UHFFFAOYSA-N Synonym: benzo b thiophene-7-carboxylic acid,benzo b thiophene-7-carboxylicacid,7-carboxybenzo b thiophene,1-benzo b thiophene-7-carboxylic acid PubChem CID: 14235073 IUPAC Name: 1-benzothiophene-7-carboxylic acid SMILES: C1=CC2=C(C(=C1)C(=O)O)SC=C2
| PubChem CID | 14235073 |
|---|---|
| CAS | 10134-98-2 |
| Molecular Weight (g/mol) | 178.205 |
| SMILES | C1=CC2=C(C(=C1)C(=O)O)SC=C2 |
| Synonym | benzo b thiophene-7-carboxylic acid,benzo b thiophene-7-carboxylicacid,7-carboxybenzo b thiophene,1-benzo b thiophene-7-carboxylic acid |
| IUPAC Name | 1-benzothiophene-7-carboxylic acid |
| InChI Key | LJPSRTWIAXVPIS-UHFFFAOYSA-N |
| Molecular Formula | C9H6O2S |
Cyclohexyl acrylate, 98+%, stab. with 100ppm 4-methoxyphenol, Thermo Scientific Chemicals
CAS: 3066-71-5 Molecular Formula: C9H14O2 Molecular Weight (g/mol): 154.21 MDL Number: MFCD00046349 InChI Key: KBLWLMPSVYBVDK-UHFFFAOYSA-N Synonym: cyclohexyl acrylate,2-propenoic acid, cyclohexyl ester,sartomer sr 220,acrylic acid, cyclohexyl ester,acrylic acid cyclohexyl ester,cyclohexylacrylate,acrylic acid cyclohexyl,acmc-209slu,wln: l6tj aov1u1,4-06-00-00038 beilstein handbook reference PubChem CID: 18298 IUPAC Name: cyclohexyl prop-2-enoate SMILES: C=CC(=O)OC1CCCCC1
| PubChem CID | 18298 |
|---|---|
| CAS | 3066-71-5 |
| Molecular Weight (g/mol) | 154.21 |
| MDL Number | MFCD00046349 |
| SMILES | C=CC(=O)OC1CCCCC1 |
| Synonym | cyclohexyl acrylate,2-propenoic acid, cyclohexyl ester,sartomer sr 220,acrylic acid, cyclohexyl ester,acrylic acid cyclohexyl ester,cyclohexylacrylate,acrylic acid cyclohexyl,acmc-209slu,wln: l6tj aov1u1,4-06-00-00038 beilstein handbook reference |
| IUPAC Name | cyclohexyl prop-2-enoate |
| InChI Key | KBLWLMPSVYBVDK-UHFFFAOYSA-N |
| Molecular Formula | C9H14O2 |
Ethyl 2-bromoisobutyrate, 98+%
CAS: 600-00-0 Molecular Formula: C6H11BrO2 Molecular Weight (g/mol): 195.06 MDL Number: MFCD00000123 InChI Key: IOLQWGVDEFWYNP-UHFFFAOYSA-N Synonym: ethyl 2-bromoisobutyrate,ethyl 2-bromo-2-methylpropionate,ethyl alpha-bromoisobutyrate,ethyl .alpha.-bromoisobutyrate,propanoic acid, 2-bromo-2-methyl-, ethyl ester,2-bromo-2-methylpropanoic acid, ethyl ester,ethyl-2-bromoisobutyrate,propanoic acid, bromo-2-methyl-, ethyl ester,ethyl 2-bromo-2-methyl-propanoate,propionic acid, 2-bromo-2-methyl-, ethyl ester PubChem CID: 11745 IUPAC Name: ethyl 2-bromo-2-methylpropanoate SMILES: CCOC(=O)C(C)(C)Br
| PubChem CID | 11745 |
|---|---|
| CAS | 600-00-0 |
| Molecular Weight (g/mol) | 195.06 |
| MDL Number | MFCD00000123 |
| SMILES | CCOC(=O)C(C)(C)Br |
| Synonym | ethyl 2-bromoisobutyrate,ethyl 2-bromo-2-methylpropionate,ethyl alpha-bromoisobutyrate,ethyl .alpha.-bromoisobutyrate,propanoic acid, 2-bromo-2-methyl-, ethyl ester,2-bromo-2-methylpropanoic acid, ethyl ester,ethyl-2-bromoisobutyrate,propanoic acid, bromo-2-methyl-, ethyl ester,ethyl 2-bromo-2-methyl-propanoate,propionic acid, 2-bromo-2-methyl-, ethyl ester |
| IUPAC Name | ethyl 2-bromo-2-methylpropanoate |
| InChI Key | IOLQWGVDEFWYNP-UHFFFAOYSA-N |
| Molecular Formula | C6H11BrO2 |
Biphenyl-4,4'-diboronic acid, 94%
CAS: 4151-80-8 Molecular Formula: C12H12B2O4 Molecular Weight (g/mol): 241.84 MDL Number: MFCD00151795 InChI Key: SLHKDOGTVUCXKX-UHFFFAOYSA-N Synonym: 4,4'-biphenyldiboronic acid,1,1'-biphenyl-4,4'-diyldiboronic acid,biphenyl-4,4'-diboronic acid,4-4-boronophenyl phenyl boronic acid,biphenyl-4,4'-diyldiboronic acid,pubchem5324,acmc-1apw8,4,4'-biphenyldiboric acid,4,4-biphenyldiboronic acid,4,4'-diboronobiphenyl PubChem CID: 2734608 IUPAC Name: [4-(4-boronophenyl)phenyl]boronic acid SMILES: OB(O)C1=CC=C(C=C1)C1=CC=C(C=C1)B(O)O
| PubChem CID | 2734608 |
|---|---|
| CAS | 4151-80-8 |
| Molecular Weight (g/mol) | 241.84 |
| MDL Number | MFCD00151795 |
| SMILES | OB(O)C1=CC=C(C=C1)C1=CC=C(C=C1)B(O)O |
| Synonym | 4,4'-biphenyldiboronic acid,1,1'-biphenyl-4,4'-diyldiboronic acid,biphenyl-4,4'-diboronic acid,4-4-boronophenyl phenyl boronic acid,biphenyl-4,4'-diyldiboronic acid,pubchem5324,acmc-1apw8,4,4'-biphenyldiboric acid,4,4-biphenyldiboronic acid,4,4'-diboronobiphenyl |
| IUPAC Name | [4-(4-boronophenyl)phenyl]boronic acid |
| InChI Key | SLHKDOGTVUCXKX-UHFFFAOYSA-N |
| Molecular Formula | C12H12B2O4 |
Dibenzo[b,d]thiophen-2-ylboronic acid, 97%, Thermo Scientific™
CAS: 668983-97-9 Molecular Formula: C12H9BO2S Molecular Weight (g/mol): 228.072 MDL Number: MFCD01318982 InChI Key: CSLSCVHILGCSTE-UHFFFAOYSA-N Synonym: dibenzo b,d thiophen-2-ylboronic acid,dibenzothiophene-2-boronic acid,dibenzo b,d thien-2-ylboronic acid,dibenzothiophen-2-yl-dihydroxy-borane,boronic acid, 2-dibenzothienyl,boronic acid, b-2-dibenzothienyl,dibenzo b,d thiophen-2-ylboronic acid contains varying amounts of anhydride,dibenzo b,d thien-2-ylboronic acid saltdata: free,8-thiatricyclo 7.4.0.0 2 ,? trideca-1 9 ,2 7 ,3,5,10,12-hexaen-4-ylboronic acid,ksc352o5l PubChem CID: 2794660 IUPAC Name: dibenzothiophen-2-ylboronic acid SMILES: B(C1=CC2=C(C=C1)SC3=CC=CC=C32)(O)O
| PubChem CID | 2794660 |
|---|---|
| CAS | 668983-97-9 |
| Molecular Weight (g/mol) | 228.072 |
| MDL Number | MFCD01318982 |
| SMILES | B(C1=CC2=C(C=C1)SC3=CC=CC=C32)(O)O |
| Synonym | dibenzo b,d thiophen-2-ylboronic acid,dibenzothiophene-2-boronic acid,dibenzo b,d thien-2-ylboronic acid,dibenzothiophen-2-yl-dihydroxy-borane,boronic acid, 2-dibenzothienyl,boronic acid, b-2-dibenzothienyl,dibenzo b,d thiophen-2-ylboronic acid contains varying amounts of anhydride,dibenzo b,d thien-2-ylboronic acid saltdata: free,8-thiatricyclo 7.4.0.0 2 ,? trideca-1 9 ,2 7 ,3,5,10,12-hexaen-4-ylboronic acid,ksc352o5l |
| IUPAC Name | dibenzothiophen-2-ylboronic acid |
| InChI Key | CSLSCVHILGCSTE-UHFFFAOYSA-N |
| Molecular Formula | C12H9BO2S |
Nickel(II) citrate hydrate, 98%
CAS: 6018-92-4 Molecular Formula: C12H10Ni3O14 Molecular Weight (g/mol): 554.28 MDL Number: MFCD00054366 InChI Key: UPPLJLAHMKABPR-UHFFFAOYSA-H Synonym: nickel ii citrate hydrate PubChem CID: 131881812 IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid;nickel SMILES: [Ni++].[Ni++].[Ni++].OC(CC([O-])=O)(CC([O-])=O)C([O-])=O.OC(CC([O-])=O)(CC([O-])=O)C([O-])=O
| PubChem CID | 131881812 |
|---|---|
| CAS | 6018-92-4 |
| Molecular Weight (g/mol) | 554.28 |
| MDL Number | MFCD00054366 |
| SMILES | [Ni++].[Ni++].[Ni++].OC(CC([O-])=O)(CC([O-])=O)C([O-])=O.OC(CC([O-])=O)(CC([O-])=O)C([O-])=O |
| Synonym | nickel ii citrate hydrate |
| IUPAC Name | 2-hydroxypropane-1,2,3-tricarboxylic acid;nickel |
| InChI Key | UPPLJLAHMKABPR-UHFFFAOYSA-H |
| Molecular Formula | C12H10Ni3O14 |
Naproxen sodium, 98%
CAS: 26159-34-2 Molecular Formula: C14H13NaO3 Molecular Weight (g/mol): 252.25 MDL Number: MFCD00058507 InChI Key: CDBRNDSHEYLDJV-FVGYRXGTSA-M Synonym: naproxen sodium,anaprox,miranax,naprelan,naproxen sodium salt,anapran,anaprotab,aprowell,floginex,flogogin PubChem CID: 23681059 ChEBI: CHEBI:7477 IUPAC Name: sodium (2S)-2-(6-methoxynaphthalen-2-yl)propanoate SMILES: [Na+].COC1=CC=C2C=C(C=CC2=C1)[C@H](C)C([O-])=O
| PubChem CID | 23681059 |
|---|---|
| CAS | 26159-34-2 |
| Molecular Weight (g/mol) | 252.25 |
| ChEBI | CHEBI:7477 |
| MDL Number | MFCD00058507 |
| SMILES | [Na+].COC1=CC=C2C=C(C=CC2=C1)[C@H](C)C([O-])=O |
| Synonym | naproxen sodium,anaprox,miranax,naprelan,naproxen sodium salt,anapran,anaprotab,aprowell,floginex,flogogin |
| IUPAC Name | sodium (2S)-2-(6-methoxynaphthalen-2-yl)propanoate |
| InChI Key | CDBRNDSHEYLDJV-FVGYRXGTSA-M |
| Molecular Formula | C14H13NaO3 |
Ethyl 2,3-dibromopropionate, 97%
CAS: 3674-13-3 Molecular Formula: C5H8Br2O2 Molecular Weight (g/mol): 259.925 MDL Number: MFCD00000212 InChI Key: OENICUBCLXKLJQ-UHFFFAOYSA-N PubChem CID: 97945 IUPAC Name: ethyl 2,3-dibromopropanoate SMILES: CCOC(=O)C(CBr)Br
| PubChem CID | 97945 |
|---|---|
| CAS | 3674-13-3 |
| Molecular Weight (g/mol) | 259.925 |
| MDL Number | MFCD00000212 |
| SMILES | CCOC(=O)C(CBr)Br |
| IUPAC Name | ethyl 2,3-dibromopropanoate |
| InChI Key | OENICUBCLXKLJQ-UHFFFAOYSA-N |
| Molecular Formula | C5H8Br2O2 |
N-Benzylacetamide, Spectrum™ Chemical
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CAS: 588-46-5
| CAS | 588-46-5 |
|---|