Carboxylic acids and derivatives
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Ethyl phenylcyanoacetate, 97%
CAS: 4553-07-5 Molecular Formula: C11H11NO2 Molecular Weight (g/mol): 189.21 MDL Number: MFCD00001866 InChI Key: SXIRJEDGTAKGKU-UHFFFAOYNA-N SMILES: CCOC(=O)C(C#N)C1=CC=CC=C1
| CAS | 4553-07-5 |
|---|---|
| Molecular Weight (g/mol) | 189.21 |
| MDL Number | MFCD00001866 |
| SMILES | CCOC(=O)C(C#N)C1=CC=CC=C1 |
| InChI Key | SXIRJEDGTAKGKU-UHFFFAOYNA-N |
| Molecular Formula | C11H11NO2 |
4-Acetamidoantipyrine, 97%
CAS: 83-15-8 Molecular Formula: C13H15N3O2 Molecular Weight (g/mol): 245.282 MDL Number: MFCD00003141 InChI Key: OIAGWXKSCXPNNZ-UHFFFAOYSA-N Synonym: 4-acetamidoantipyrine,4-acetaminoantipyrine,acetamidoantipyrine,acetylaminoantipyrine,4-acetoaminoantipyrine,4-acetylaminophenazone,4-acetylaminoantipyrine,antipyrine, 4-acetamido,n-acetyl-4-aminoantipyrine,acetylated 4-aminoantipyrine PubChem CID: 65743 ChEBI: CHEBI:83513 IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C
| PubChem CID | 65743 |
|---|---|
| CAS | 83-15-8 |
| Molecular Weight (g/mol) | 245.282 |
| ChEBI | CHEBI:83513 |
| MDL Number | MFCD00003141 |
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C |
| Synonym | 4-acetamidoantipyrine,4-acetaminoantipyrine,acetamidoantipyrine,acetylaminoantipyrine,4-acetoaminoantipyrine,4-acetylaminophenazone,4-acetylaminoantipyrine,antipyrine, 4-acetamido,n-acetyl-4-aminoantipyrine,acetylated 4-aminoantipyrine |
| IUPAC Name | N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide |
| InChI Key | OIAGWXKSCXPNNZ-UHFFFAOYSA-N |
| Molecular Formula | C13H15N3O2 |
2-Aminobenzhydrazide, 98+%
CAS: 1904-58-1 Molecular Formula: C7H9N3O Molecular Weight (g/mol): 151.17 MDL Number: MFCD00017056 InChI Key: GRWMSCBKWMQPON-UHFFFAOYSA-N Synonym: 2-aminobenzhydrazide,o-aminobenzhydrazide,anthranilic acid hydrazide,benzoic acid, 2-amino-, hydrazide,anthranilic hydrazide,anthraniloyl hydrazide,anthraniloyl hydrazine,2-aminobenzoylhydrazine,2-aminobenzoic acid hydrazide,o-aminobenzoic hydrazide PubChem CID: 94728 IUPAC Name: 2-aminobenzohydrazide SMILES: NNC(=O)C1=CC=CC=C1N
| PubChem CID | 94728 |
|---|---|
| CAS | 1904-58-1 |
| Molecular Weight (g/mol) | 151.17 |
| MDL Number | MFCD00017056 |
| SMILES | NNC(=O)C1=CC=CC=C1N |
| Synonym | 2-aminobenzhydrazide,o-aminobenzhydrazide,anthranilic acid hydrazide,benzoic acid, 2-amino-, hydrazide,anthranilic hydrazide,anthraniloyl hydrazide,anthraniloyl hydrazine,2-aminobenzoylhydrazine,2-aminobenzoic acid hydrazide,o-aminobenzoic hydrazide |
| IUPAC Name | 2-aminobenzohydrazide |
| InChI Key | GRWMSCBKWMQPON-UHFFFAOYSA-N |
| Molecular Formula | C7H9N3O |
Spectrum Chemical Manufacturing Corporation 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 |
Isopropenyl acetate, 99%
CAS: 108-22-5 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00008709 InChI Key: HETCEOQFVDFGSY-UHFFFAOYSA-N Synonym: isopropenyl acetate,2-acetoxypropene,1-methylvinyl acetate,2-acetoxypropylene,methylvinyl acetate,1-propen-2-ol, acetate,propen-2-yl acetate,acetic acid isopropenyl ester,1-acetoxy-1-methylethylene,1-propen-2-yl acetate PubChem CID: 7916 IUPAC Name: prop-1-en-2-yl acetate SMILES: CC(=C)OC(C)=O
| PubChem CID | 7916 |
|---|---|
| CAS | 108-22-5 |
| Molecular Weight (g/mol) | 100.12 |
| MDL Number | MFCD00008709 |
| SMILES | CC(=C)OC(C)=O |
| Synonym | isopropenyl acetate,2-acetoxypropene,1-methylvinyl acetate,2-acetoxypropylene,methylvinyl acetate,1-propen-2-ol, acetate,propen-2-yl acetate,acetic acid isopropenyl ester,1-acetoxy-1-methylethylene,1-propen-2-yl acetate |
| IUPAC Name | prop-1-en-2-yl acetate |
| InChI Key | HETCEOQFVDFGSY-UHFFFAOYSA-N |
| Molecular Formula | C5H8O2 |
N-(4-Bromobutyl)phthalimide, 96%
CAS: 5394-18-3 Molecular Formula: C12H12BrNO2 Molecular Weight (g/mol): 282.14 MDL Number: MFCD00005905 InChI Key: UXFWTIGUWHJKDD-UHFFFAOYSA-N Synonym: n-4-bromobutyl phthalimide,2-4-bromobutyl isoindoline-1,3-dione,1h-isoindole-1,3 2h-dione, 2-4-bromobutyl,2-4-bromobutyl-1h-isoindole-1,3 2h-dione,n-4-bromobutyl-phthalimide,2-4-bromobutyl isoindole-1,3-dione,2-4-bromobutyl-2,3-dihydro-1h-isoindole-1,3-dione,n-4-bromobutyl,n-bromobutylphthalimide PubChem CID: 93575 IUPAC Name: 2-(4-bromobutyl)isoindole-1,3-dione SMILES: BrCCCCN1C(=O)C2=CC=CC=C2C1=O
| PubChem CID | 93575 |
|---|---|
| CAS | 5394-18-3 |
| Molecular Weight (g/mol) | 282.14 |
| MDL Number | MFCD00005905 |
| SMILES | BrCCCCN1C(=O)C2=CC=CC=C2C1=O |
| Synonym | n-4-bromobutyl phthalimide,2-4-bromobutyl isoindoline-1,3-dione,1h-isoindole-1,3 2h-dione, 2-4-bromobutyl,2-4-bromobutyl-1h-isoindole-1,3 2h-dione,n-4-bromobutyl-phthalimide,2-4-bromobutyl isoindole-1,3-dione,2-4-bromobutyl-2,3-dihydro-1h-isoindole-1,3-dione,n-4-bromobutyl,n-bromobutylphthalimide |
| IUPAC Name | 2-(4-bromobutyl)isoindole-1,3-dione |
| InChI Key | UXFWTIGUWHJKDD-UHFFFAOYSA-N |
| Molecular Formula | C12H12BrNO2 |
5-Bromooxindole, 97%, Thermo Scientific™
CAS: 20870-78-4 Molecular Formula: C8H6BrNO Molecular Weight (g/mol): 212.046 InChI Key: VIMNAEVMZXIKFL-UHFFFAOYSA-N Synonym: 5-bromooxindole,5-bromoindolin-2-one,5-bromo-2-oxindole,5-bromo-1,3-dihydro-2h-indol-2-one,5-bromo-2,3-dihydro-1h-indol-2-one,5-bromo-2-indolinone,5-bromo-1,3-dihydro-indol-2-one,2h-indol-2-one, 5-bromo-1,3-dihydro,5-bromo-2-oxindol,1,3-dihydro-5-bromoindol-2-one PubChem CID: 611193 IUPAC Name: 5-bromo-1,3-dihydroindol-2-one SMILES: C1C2=C(C=CC(=C2)Br)NC1=O
| PubChem CID | 611193 |
|---|---|
| CAS | 20870-78-4 |
| Molecular Weight (g/mol) | 212.046 |
| SMILES | C1C2=C(C=CC(=C2)Br)NC1=O |
| Synonym | 5-bromooxindole,5-bromoindolin-2-one,5-bromo-2-oxindole,5-bromo-1,3-dihydro-2h-indol-2-one,5-bromo-2,3-dihydro-1h-indol-2-one,5-bromo-2-indolinone,5-bromo-1,3-dihydro-indol-2-one,2h-indol-2-one, 5-bromo-1,3-dihydro,5-bromo-2-oxindol,1,3-dihydro-5-bromoindol-2-one |
| IUPAC Name | 5-bromo-1,3-dihydroindol-2-one |
| InChI Key | VIMNAEVMZXIKFL-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrNO |
Ethyl oleate, tech. 70%
CAS: 111-62-6 Molecular Formula: C20H38O2 Molecular Weight (g/mol): 310.522 MDL Number: MFCD00009579 InChI Key: LVGKNOAMLMIIKO-QXMHVHEDSA-N Synonym: ethyl oleate,ethyl cis-9-octadecenoate,oleic acid, ethyl ester,oleic acid ethyl ester,9-octadecenoic acid z-, ethyl ester,ethyl oleate nf,ethyl z-octadec-9-enoate,ethyl oleate natural,fema no. 2450 PubChem CID: 5363269 ChEBI: CHEBI:84940 IUPAC Name: ethyl (Z)-octadec-9-enoate SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC
| PubChem CID | 5363269 |
|---|---|
| CAS | 111-62-6 |
| Molecular Weight (g/mol) | 310.522 |
| ChEBI | CHEBI:84940 |
| MDL Number | MFCD00009579 |
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCC |
| Synonym | ethyl oleate,ethyl cis-9-octadecenoate,oleic acid, ethyl ester,oleic acid ethyl ester,9-octadecenoic acid z-, ethyl ester,ethyl oleate nf,ethyl z-octadec-9-enoate,ethyl oleate natural,fema no. 2450 |
| IUPAC Name | ethyl (Z)-octadec-9-enoate |
| InChI Key | LVGKNOAMLMIIKO-QXMHVHEDSA-N |
| Molecular Formula | C20H38O2 |
1,3,5-Benzenetricarboxylic acid, 98%
CAS: 554-95-0 Molecular Formula: C9H6O6 Molecular Weight (g/mol): 210.14 MDL Number: MFCD00002517 InChI Key: QMKYBPDZANOJGF-UHFFFAOYSA-N Synonym: trimesic acid,1,3,5-benzenetricarboxylic acid,trimesinic acid,trimesitinic acid,5-carboxyisophthalic acid,1,3,5-benzene tricarboxylic acid,1,3,5-tricarboxybenzene,unii-ou36oo5mtn,ou36oo5mtn,chembl77562 PubChem CID: 11138 ChEBI: CHEBI:46032 IUPAC Name: benzene-1,3,5-tricarboxylic acid SMILES: OC(=O)C1=CC(=CC(=C1)C(O)=O)C(O)=O
| PubChem CID | 11138 |
|---|---|
| CAS | 554-95-0 |
| Molecular Weight (g/mol) | 210.14 |
| ChEBI | CHEBI:46032 |
| MDL Number | MFCD00002517 |
| SMILES | OC(=O)C1=CC(=CC(=C1)C(O)=O)C(O)=O |
| Synonym | trimesic acid,1,3,5-benzenetricarboxylic acid,trimesinic acid,trimesitinic acid,5-carboxyisophthalic acid,1,3,5-benzene tricarboxylic acid,1,3,5-tricarboxybenzene,unii-ou36oo5mtn,ou36oo5mtn,chembl77562 |
| IUPAC Name | benzene-1,3,5-tricarboxylic acid |
| InChI Key | QMKYBPDZANOJGF-UHFFFAOYSA-N |
| Molecular Formula | C9H6O6 |
3-Indoxyl acetate, 97%
CAS: 608-08-2 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.187 MDL Number: MFCD00014561 InChI Key: JBOPQACSHPPKEP-UHFFFAOYSA-N Synonym: 3-acetoxyindole,indoxyl acetate,3-indoxyl acetate,indoxyl-o-acetate,3-indolyl acetate,indole, 3-acetato,indoxylacetate,1h-indol-3-ol, 3-acetate,1h-indol-3-ol, acetate ester,acetic acid, 3-indolyl ester PubChem CID: 11841 IUPAC Name: 1H-indol-3-yl acetate SMILES: CC(=O)OC1=CNC2=CC=CC=C21
| PubChem CID | 11841 |
|---|---|
| CAS | 608-08-2 |
| Molecular Weight (g/mol) | 175.187 |
| MDL Number | MFCD00014561 |
| SMILES | CC(=O)OC1=CNC2=CC=CC=C21 |
| Synonym | 3-acetoxyindole,indoxyl acetate,3-indoxyl acetate,indoxyl-o-acetate,3-indolyl acetate,indole, 3-acetato,indoxylacetate,1h-indol-3-ol, 3-acetate,1h-indol-3-ol, acetate ester,acetic acid, 3-indolyl ester |
| IUPAC Name | 1H-indol-3-yl acetate |
| InChI Key | JBOPQACSHPPKEP-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO2 |
Methyl dichloroacetate, 99%
CAS: 116-54-1 Molecular Formula: C3H4Cl2O2 Molecular Weight (g/mol): 142.963 MDL Number: MFCD00000843 InChI Key: HKMLRUAPIDAGIE-UHFFFAOYSA-N Synonym: methyl dichloroacetate,dichloroacetic acid methyl ester,acetic acid, dichloro-, methyl ester,ccris 7740,acetic acid, 2,2-dichloro-, methyl ester,methyldichloroethanoate,acmc-1brpm,dichloroacetic acid methyl,methyl2,2-dichloroacetate,wln: gygvo1 PubChem CID: 8315 IUPAC Name: methyl 2,2-dichloroacetate SMILES: COC(=O)C(Cl)Cl
| PubChem CID | 8315 |
|---|---|
| CAS | 116-54-1 |
| Molecular Weight (g/mol) | 142.963 |
| MDL Number | MFCD00000843 |
| SMILES | COC(=O)C(Cl)Cl |
| Synonym | methyl dichloroacetate,dichloroacetic acid methyl ester,acetic acid, dichloro-, methyl ester,ccris 7740,acetic acid, 2,2-dichloro-, methyl ester,methyldichloroethanoate,acmc-1brpm,dichloroacetic acid methyl,methyl2,2-dichloroacetate,wln: gygvo1 |
| IUPAC Name | methyl 2,2-dichloroacetate |
| InChI Key | HKMLRUAPIDAGIE-UHFFFAOYSA-N |
| Molecular Formula | C3H4Cl2O2 |
Benzyl methacrylate, 98%, stab. with ca 50-100ppm 4-methoxyphenol
CAS: 2495-37-6 Molecular Formula: C11H12O2 Molecular Weight (g/mol): 176.215 MDL Number: MFCD00053684 InChI Key: AOJOEFVRHOZDFN-UHFFFAOYSA-N Synonym: benzyl methacrylate,2-propenoic acid, 2-methyl-, phenylmethyl ester,benzylmethacrylate,methacrylic acid benzyl ester,methacrylic acid, benzyl ester,unii-z3248k2ssm,phenylmethyl 2-methylprop-2-enoate,poly benzylmethacrylate,bzma,methacrylic acid benzyl PubChem CID: 17236 IUPAC Name: benzyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCC1=CC=CC=C1
| PubChem CID | 17236 |
|---|---|
| CAS | 2495-37-6 |
| Molecular Weight (g/mol) | 176.215 |
| MDL Number | MFCD00053684 |
| SMILES | CC(=C)C(=O)OCC1=CC=CC=C1 |
| Synonym | benzyl methacrylate,2-propenoic acid, 2-methyl-, phenylmethyl ester,benzylmethacrylate,methacrylic acid benzyl ester,methacrylic acid, benzyl ester,unii-z3248k2ssm,phenylmethyl 2-methylprop-2-enoate,poly benzylmethacrylate,bzma,methacrylic acid benzyl |
| IUPAC Name | benzyl 2-methylprop-2-enoate |
| InChI Key | AOJOEFVRHOZDFN-UHFFFAOYSA-N |
| Molecular Formula | C11H12O2 |
Methyl oxalyl chloride, 97%
CAS: 5781-53-3 Molecular Formula: C3H3ClO3 Molecular Weight (g/mol): 122.504 MDL Number: MFCD00000705 InChI Key: ZXUQEPZWVQIOJE-UHFFFAOYSA-N Synonym: methyl oxalyl chloride,methyl chloroglyoxylate,methyl chlorooxoacetate,chloroglyoxylic acid methyl ester,acetic acid, chlorooxo-, methyl ester,methyl chlorocarbonyl formate,methyloxalylchloride,methyl chloro oxo acetate,methylchlorooxoacetate,methyl 2-chloro-2-oxo-acetate PubChem CID: 79846 IUPAC Name: methyl 2-chloro-2-oxoacetate SMILES: COC(=O)C(=O)Cl
| PubChem CID | 79846 |
|---|---|
| CAS | 5781-53-3 |
| Molecular Weight (g/mol) | 122.504 |
| MDL Number | MFCD00000705 |
| SMILES | COC(=O)C(=O)Cl |
| Synonym | methyl oxalyl chloride,methyl chloroglyoxylate,methyl chlorooxoacetate,chloroglyoxylic acid methyl ester,acetic acid, chlorooxo-, methyl ester,methyl chlorocarbonyl formate,methyloxalylchloride,methyl chloro oxo acetate,methylchlorooxoacetate,methyl 2-chloro-2-oxo-acetate |
| IUPAC Name | methyl 2-chloro-2-oxoacetate |
| InChI Key | ZXUQEPZWVQIOJE-UHFFFAOYSA-N |
| Molecular Formula | C3H3ClO3 |
Thermo Scientific Chemicals 1,2,3,5-Tetra-O-acetyl-beta-L-ribofuranose, 98%
CAS: 144490-03-9 Molecular Formula: C13H18O9 Molecular Weight (g/mol): 318.278 MDL Number: MFCD00674547 InChI Key: IHNHAHWGVLXCCI-UMSGYPCISA-N Synonym: 1,2,3,5-tetra-o-acetyl-beta-l-ribofuranose,1,2,3,5-tetra-o-acetyl-b-l-ribofuranose,2s,3s,4s,5r-3,4,5-tris acetyloxy oxolan-2-yl methyl acetate,beta-l-ribofuranose 1,2,3,5-tetra-o-acetate,beta-l-ribofuranose tetraacetate,1,2,3,5-tetra-o-acetyl-?-l-ribofuranose,2s,3s,4s,5r-3,4,5-triacetyloxyoxolan-2-yl methyl acetate,2r,3s,4s,5s-5-acetoxymethyl tetrahydrofuran-2,3,4-triyl triacetate PubChem CID: 69431757 IUPAC Name: [(2S,3R,4R,5S)-3,4,5-triacetyloxyoxolan-2-yl]methyl acetate SMILES: CC(=O)OCC1C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C
| PubChem CID | 69431757 |
|---|---|
| CAS | 144490-03-9 |
| Molecular Weight (g/mol) | 318.278 |
| MDL Number | MFCD00674547 |
| SMILES | CC(=O)OCC1C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C |
| Synonym | 1,2,3,5-tetra-o-acetyl-beta-l-ribofuranose,1,2,3,5-tetra-o-acetyl-b-l-ribofuranose,2s,3s,4s,5r-3,4,5-tris acetyloxy oxolan-2-yl methyl acetate,beta-l-ribofuranose 1,2,3,5-tetra-o-acetate,beta-l-ribofuranose tetraacetate,1,2,3,5-tetra-o-acetyl-?-l-ribofuranose,2s,3s,4s,5r-3,4,5-triacetyloxyoxolan-2-yl methyl acetate,2r,3s,4s,5s-5-acetoxymethyl tetrahydrofuran-2,3,4-triyl triacetate |
| IUPAC Name | [(2S,3R,4R,5S)-3,4,5-triacetyloxyoxolan-2-yl]methyl acetate |
| InChI Key | IHNHAHWGVLXCCI-UMSGYPCISA-N |
| Molecular Formula | C13H18O9 |
N-(Chloromethyl)phthalimide, 97%
CAS: 17564-64-6 Molecular Formula: C9H6ClNO2 Molecular Weight (g/mol): 195.602 MDL Number: MFCD00005898 InChI Key: JKGLRGGCGUQNEX-UHFFFAOYSA-N Synonym: n-chloromethyl phthalimide,2-chloromethyl isoindoline-1,3-dione,n-chloromethylphthalimide,chloromethylphthalimide,n-chloromethyltrimellitimide,1h-isoindole-1,3 2h-dione, 2-chloromethyl,phthalimide, n-chloromethyl,2-chloromethyl isoindole-1,3-dione,2-chloromethyl-1h-isoindole-1,3 2h-dione PubChem CID: 87154 IUPAC Name: 2-(chloromethyl)isoindole-1,3-dione SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CCl
| PubChem CID | 87154 |
|---|---|
| CAS | 17564-64-6 |
| Molecular Weight (g/mol) | 195.602 |
| MDL Number | MFCD00005898 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCl |
| Synonym | n-chloromethyl phthalimide,2-chloromethyl isoindoline-1,3-dione,n-chloromethylphthalimide,chloromethylphthalimide,n-chloromethyltrimellitimide,1h-isoindole-1,3 2h-dione, 2-chloromethyl,phthalimide, n-chloromethyl,2-chloromethyl isoindole-1,3-dione,2-chloromethyl-1h-isoindole-1,3 2h-dione |
| IUPAC Name | 2-(chloromethyl)isoindole-1,3-dione |
| InChI Key | JKGLRGGCGUQNEX-UHFFFAOYSA-N |
| Molecular Formula | C9H6ClNO2 |