Organic acids and derivatives
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Methyl 3,4-diaminobenzoate, 98%
CAS: 36692-49-6 Molecular Formula: C8H10N2O2 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00017098 InChI Key: IOPLHGOSNCJOOO-UHFFFAOYSA-N Synonym: 3,4-diaminobenzoic acid methyl ester,methyl3,4-diaminobenzoate,methyl-3,4-diaminobenzoate,benzoic acid, 3,4-diamino-, methyl ester,3,4-diamino-benzoic acid methyl ester,methyl 3,4-diaminobenzenecarboxylate,pubchem4610,acmc-1bn7s,methyl 3,4-diamino-benzoate,methyl-3,4-diamino-benzoate PubChem CID: 135524 IUPAC Name: methyl 3,4-diaminobenzoate SMILES: COC(=O)C1=CC=C(N)C(N)=C1
| PubChem CID | 135524 |
|---|---|
| CAS | 36692-49-6 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00017098 |
| SMILES | COC(=O)C1=CC=C(N)C(N)=C1 |
| Synonym | 3,4-diaminobenzoic acid methyl ester,methyl3,4-diaminobenzoate,methyl-3,4-diaminobenzoate,benzoic acid, 3,4-diamino-, methyl ester,3,4-diamino-benzoic acid methyl ester,methyl 3,4-diaminobenzenecarboxylate,pubchem4610,acmc-1bn7s,methyl 3,4-diamino-benzoate,methyl-3,4-diamino-benzoate |
| IUPAC Name | methyl 3,4-diaminobenzoate |
| InChI Key | IOPLHGOSNCJOOO-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2O2 |
3-Methoxyphenylboronic acid, 97%
CAS: 10365-98-7 Molecular Formula: C7H9BO3 Molecular Weight (g/mol): 151.96 MDL Number: MFCD00161359 InChI Key: NLLGFYPSWCMUIV-UHFFFAOYSA-N Synonym: 3-methoxyphenyl boronic acid,3-methoxybenzeneboronic acid,3-methoxyphenyl boranediol,3-methoxypenylboronic acid,3-boronanisole,3-boronoanisole,boronic acid, 3-methoxyphenyl,m-methoxyphenylboronic acid,3-methoxy phenylboronic acid PubChem CID: 2734370 IUPAC Name: (3-methoxyphenyl)boronic acid SMILES: COC1=CC=CC(=C1)B(O)O
| PubChem CID | 2734370 |
|---|---|
| CAS | 10365-98-7 |
| Molecular Weight (g/mol) | 151.96 |
| MDL Number | MFCD00161359 |
| SMILES | COC1=CC=CC(=C1)B(O)O |
| Synonym | 3-methoxyphenyl boronic acid,3-methoxybenzeneboronic acid,3-methoxyphenyl boranediol,3-methoxypenylboronic acid,3-boronanisole,3-boronoanisole,boronic acid, 3-methoxyphenyl,m-methoxyphenylboronic acid,3-methoxy phenylboronic acid |
| IUPAC Name | (3-methoxyphenyl)boronic acid |
| InChI Key | NLLGFYPSWCMUIV-UHFFFAOYSA-N |
| Molecular Formula | C7H9BO3 |
Diphenylamine-4-sulfonic acid, sodium salt, ACS reagent
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: sodium;4-anilinobenzenesulfonate 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 | sodium;4-anilinobenzenesulfonate |
| InChI Key | VMVSDVIYIMNZBS-UHFFFAOYSA-N |
| Molecular Formula | C12H11NNaO3S |
Ethyl iodoacetate, 98%, stabilized, Thermo Scientific Chemicals
CAS: 623-48-3 Molecular Formula: C4H7IO2 Molecular Weight (g/mol): 214.00 MDL Number: MFCD00001081 InChI Key: MFFXVVHUKRKXCI-UHFFFAOYSA-N Synonym: ethyl iodoacetate,acetic acid, iodo-, ethyl ester,ethyl monoiodoacetate,iodoacetic acid, ethyl ester,acetic acid, 2-iodo-, ethyl ester,ethylester kyseliny jodoctove czech,acetic acid, 2-iodo-,ethyl ester,ethylester kyseliny jodoctove,ethyliodoacetate,iodoacetic acid ethyl PubChem CID: 12183 IUPAC Name: ethyl 2-iodoacetate SMILES: CCOC(=O)CI
| PubChem CID | 12183 |
|---|---|
| CAS | 623-48-3 |
| Molecular Weight (g/mol) | 214.00 |
| MDL Number | MFCD00001081 |
| SMILES | CCOC(=O)CI |
| Synonym | ethyl iodoacetate,acetic acid, iodo-, ethyl ester,ethyl monoiodoacetate,iodoacetic acid, ethyl ester,acetic acid, 2-iodo-, ethyl ester,ethylester kyseliny jodoctove czech,acetic acid, 2-iodo-,ethyl ester,ethylester kyseliny jodoctove,ethyliodoacetate,iodoacetic acid ethyl |
| IUPAC Name | ethyl 2-iodoacetate |
| InChI Key | MFFXVVHUKRKXCI-UHFFFAOYSA-N |
| Molecular Formula | C4H7IO2 |
1,2,3,4-Butanetetracarboxylic acid, 99+%
CAS: 1703-58-8 Molecular Formula: C8H10O8 Molecular Weight (g/mol): 234.16 MDL Number: MFCD00002722 InChI Key: GGAUUQHSCNMCAU-UHFFFAOYSA-N Synonym: 1,2,3,4-butanetetracarboxylic acid,butanetetracarboxylic acid,dsstox_cid_4670,dsstox_rid_77494,dsstox_gsid_24670,1,2,3,4-butanetetracarboxylic,meso-1,2,3,4-butanetetracarboxylic acid,acmc-20abw3,ksc176c1b,ggauuqhscnmcau-uhfffaoysa PubChem CID: 15560 IUPAC Name: butane-1,2,3,4-tetracarboxylic acid SMILES: C(C(C(CC(=O)O)C(=O)O)C(=O)O)C(=O)O
| PubChem CID | 15560 |
|---|---|
| CAS | 1703-58-8 |
| Molecular Weight (g/mol) | 234.16 |
| MDL Number | MFCD00002722 |
| SMILES | C(C(C(CC(=O)O)C(=O)O)C(=O)O)C(=O)O |
| Synonym | 1,2,3,4-butanetetracarboxylic acid,butanetetracarboxylic acid,dsstox_cid_4670,dsstox_rid_77494,dsstox_gsid_24670,1,2,3,4-butanetetracarboxylic,meso-1,2,3,4-butanetetracarboxylic acid,acmc-20abw3,ksc176c1b,ggauuqhscnmcau-uhfffaoysa |
| IUPAC Name | butane-1,2,3,4-tetracarboxylic acid |
| InChI Key | GGAUUQHSCNMCAU-UHFFFAOYSA-N |
| Molecular Formula | C8H10O8 |
1-Adamantanecarboxylic acid, 99%
CAS: 828-51-3 Molecular Formula: C11H16O2 Molecular Weight (g/mol): 180.25 MDL Number: MFCD00074720 InChI Key: JIMXXGFJRDUSRO-UHFFFAOYSA-N Synonym: 1-adamantanecarboxylic acid,1-carboxyadamantane,adamantanecarboxylic acid,adamantoic acid,1-adamantoic acid,3-adamantanecarboxylic acid,tricyclo 3.3.1.13,7 decane-1-carboxylic acid,tricyclo 3.3.1.1'3,7 decane-1-carboxylic acid,tricyclo 3.3.1.1∼3,7∼ decane-1-carboxylic acid,3r,5s,7s-adamantane-1-carboxylic acid PubChem CID: 13235 IUPAC Name: adamantane-1-carboxylic acid SMILES: C1C2CC3CC1CC(C2)(C3)C(=O)O
| PubChem CID | 13235 |
|---|---|
| CAS | 828-51-3 |
| Molecular Weight (g/mol) | 180.25 |
| MDL Number | MFCD00074720 |
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)O |
| Synonym | 1-adamantanecarboxylic acid,1-carboxyadamantane,adamantanecarboxylic acid,adamantoic acid,1-adamantoic acid,3-adamantanecarboxylic acid,tricyclo 3.3.1.13,7 decane-1-carboxylic acid,tricyclo 3.3.1.1'3,7 decane-1-carboxylic acid,tricyclo 3.3.1.1∼3,7∼ decane-1-carboxylic acid,3r,5s,7s-adamantane-1-carboxylic acid |
| IUPAC Name | adamantane-1-carboxylic acid |
| InChI Key | JIMXXGFJRDUSRO-UHFFFAOYSA-N |
| Molecular Formula | C11H16O2 |
7-Methyl lumazine
CAS: 13401-38-2 Molecular Formula: C7H6N4O2 Molecular Weight (g/mol): 178.15 MDL Number: MFCD19688352 InChI Key: WIXGFZWEUAUYGB-UHFFFAOYSA-N Synonym: 7-methyl lumazine,7-methyllumazine,7-methyllumizine,lumazine, 7-methyl,7-methylpteridine-2,4 1h,3h-dione,7-methylpteridine-2,4-diol,2,4 1h,3h-pteridinedione, 7-methyl,7-methyl-1,3-dihydropteridine-2,4-dione,7-methyl-pteridine-2,4-diol,methyllumazin isomerengemisch PubChem CID: 5374589 IUPAC Name: 7-methyl-1H-pteridine-2,4-dione SMILES: CC1=CN=C2C(=O)NC(=O)NC2=N1
| PubChem CID | 5374589 |
|---|---|
| CAS | 13401-38-2 |
| Molecular Weight (g/mol) | 178.15 |
| MDL Number | MFCD19688352 |
| SMILES | CC1=CN=C2C(=O)NC(=O)NC2=N1 |
| Synonym | 7-methyl lumazine,7-methyllumazine,7-methyllumizine,lumazine, 7-methyl,7-methylpteridine-2,4 1h,3h-dione,7-methylpteridine-2,4-diol,2,4 1h,3h-pteridinedione, 7-methyl,7-methyl-1,3-dihydropteridine-2,4-dione,7-methyl-pteridine-2,4-diol,methyllumazin isomerengemisch |
| IUPAC Name | 7-methyl-1H-pteridine-2,4-dione |
| InChI Key | WIXGFZWEUAUYGB-UHFFFAOYSA-N |
| Molecular Formula | C7H6N4O2 |
2-(2-Cyanophenoxy)acetamide, 98%
CAS: 54802-12-9 Molecular Formula: C9H8N2O2 Molecular Weight (g/mol): 176.175 MDL Number: MFCD00297091 InChI Key: RYOYNMJXEHNYAG-UHFFFAOYSA-N Synonym: 2-2-cyanophenoxy acetamide,acetamide, 2-2-cyanophenoxy,2-cyanophenoxyacetamide PubChem CID: 12353988 IUPAC Name: 2-(2-cyanophenoxy)acetamide SMILES: C1=CC=C(C(=C1)C#N)OCC(=O)N
| PubChem CID | 12353988 |
|---|---|
| CAS | 54802-12-9 |
| Molecular Weight (g/mol) | 176.175 |
| MDL Number | MFCD00297091 |
| SMILES | C1=CC=C(C(=C1)C#N)OCC(=O)N |
| Synonym | 2-2-cyanophenoxy acetamide,acetamide, 2-2-cyanophenoxy,2-cyanophenoxyacetamide |
| IUPAC Name | 2-(2-cyanophenoxy)acetamide |
| InChI Key | RYOYNMJXEHNYAG-UHFFFAOYSA-N |
| Molecular Formula | C9H8N2O2 |
2-Fluoro-3-methoxybenzeneboronic acid, 97%, Thermo Scientific Chemicals
CAS: 352303-67-4 Molecular Formula: C7H8BFO3 Molecular Weight (g/mol): 169.946 MDL Number: MFCD02094728 InChI Key: JCKZNMSBFBPDPM-UHFFFAOYSA-N Synonym: 2-fluoro-3-methoxyphenyl boronic acid,2-fluoro-3-methoxybenzeneboronic acid,2-fluoro-3-methoxyphenyl boranediol,2-fluoro-3-methoxyphenylboronicacid,boronic acid, 2-fluoro-3-methoxyphenyl,pubchem1848,2-fluoro-3-methoxy-phenyl boronic acid,acmc-1af04,2-fluoro-3-methoxy-phenylboronic acid PubChem CID: 4985744 IUPAC Name: (2-fluoro-3-methoxyphenyl)boronic acid SMILES: B(C1=C(C(=CC=C1)OC)F)(O)O
| PubChem CID | 4985744 |
|---|---|
| CAS | 352303-67-4 |
| Molecular Weight (g/mol) | 169.946 |
| MDL Number | MFCD02094728 |
| SMILES | B(C1=C(C(=CC=C1)OC)F)(O)O |
| Synonym | 2-fluoro-3-methoxyphenyl boronic acid,2-fluoro-3-methoxybenzeneboronic acid,2-fluoro-3-methoxyphenyl boranediol,2-fluoro-3-methoxyphenylboronicacid,boronic acid, 2-fluoro-3-methoxyphenyl,pubchem1848,2-fluoro-3-methoxy-phenyl boronic acid,acmc-1af04,2-fluoro-3-methoxy-phenylboronic acid |
| IUPAC Name | (2-fluoro-3-methoxyphenyl)boronic acid |
| InChI Key | JCKZNMSBFBPDPM-UHFFFAOYSA-N |
| Molecular Formula | C7H8BFO3 |
N-Nitroso-N-methylurea, Spectrum™ Chemical
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CAS: 684-93-5
| CAS | 684-93-5 |
|---|
Cycloheptanecarboxylic acid, 95%
CAS: 1460-16-8 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00004152 InChI Key: VZFUCHSFHOYXIS-UHFFFAOYSA-N Synonym: cycloheptane carboxylic acid,cycloheptanoic acid,cycloheptanecarboxylicacid,cyclohepatan carboxylic acid,acmc-1c1rc,sampl4, o9,vzfuchsfhoyxis-uhfffaoysa,cycloheptanecarboxylic acid PubChem CID: 15091 ChEBI: CHEBI:29564 IUPAC Name: cycloheptanecarboxylic acid SMILES: OC(=O)C1CCCCCC1
| PubChem CID | 15091 |
|---|---|
| CAS | 1460-16-8 |
| Molecular Weight (g/mol) | 142.20 |
| ChEBI | CHEBI:29564 |
| MDL Number | MFCD00004152 |
| SMILES | OC(=O)C1CCCCCC1 |
| Synonym | cycloheptane carboxylic acid,cycloheptanoic acid,cycloheptanecarboxylicacid,cyclohepatan carboxylic acid,acmc-1c1rc,sampl4, o9,vzfuchsfhoyxis-uhfffaoysa,cycloheptanecarboxylic acid |
| IUPAC Name | cycloheptanecarboxylic acid |
| InChI Key | VZFUCHSFHOYXIS-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
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 |
Methyl pyrrole-2-carboxylate, 97%, Thermo Scientific Chemicals
CAS: 1193-62-0 Molecular Formula: C6H7NO2 Molecular Weight (g/mol): 125.127 MDL Number: MFCD00817048 InChI Key: VONGYFFEWFJHNP-UHFFFAOYSA-N Synonym: methyl pyrrole-2-carboxylate,methyl 2-pyrrolecarboxylate,1h-pyrrole-2-carboxylic acid, methyl ester,unii-3beg2ck3lu,pyrrole-2-carboxylic acid methyl ester,methyl1h-pyrrole-2-carboxylate,3beg2ck3lu,1h-pyrrole-2-carboxylic acid,methyl ester,pubchem9141,acmc-1bsa1 PubChem CID: 136930 IUPAC Name: methyl 1H-pyrrole-2-carboxylate SMILES: COC(=O)C1=CC=CN1
| PubChem CID | 136930 |
|---|---|
| CAS | 1193-62-0 |
| Molecular Weight (g/mol) | 125.127 |
| MDL Number | MFCD00817048 |
| SMILES | COC(=O)C1=CC=CN1 |
| Synonym | methyl pyrrole-2-carboxylate,methyl 2-pyrrolecarboxylate,1h-pyrrole-2-carboxylic acid, methyl ester,unii-3beg2ck3lu,pyrrole-2-carboxylic acid methyl ester,methyl1h-pyrrole-2-carboxylate,3beg2ck3lu,1h-pyrrole-2-carboxylic acid,methyl ester,pubchem9141,acmc-1bsa1 |
| IUPAC Name | methyl 1H-pyrrole-2-carboxylate |
| InChI Key | VONGYFFEWFJHNP-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO2 |
N,N-Diisopropylformamide, 98%
CAS: 2700-30-3 Molecular Formula: C7H15NO Molecular Weight (g/mol): 129.203 MDL Number: MFCD00008867 InChI Key: UNBDDZDKBWPHAX-UHFFFAOYSA-N Synonym: n,n-diisopropylformamide,formamide, n,n-bis 1-methylethyl,n-formyldiisopropylamine,diisopropylformamide,n,n-bis 1-methylethyl formamide,nn-di-iso-propylformamide,formamide, n,n-diisopropyl,formamide, bis 1-methylethyl,n,n-bis methylethyl carboxamide,1y1&nvhy1&1 PubChem CID: 75912 IUPAC Name: N,N-di(propan-2-yl)formamide SMILES: CC(C)N(C=O)C(C)C
| PubChem CID | 75912 |
|---|---|
| CAS | 2700-30-3 |
| Molecular Weight (g/mol) | 129.203 |
| MDL Number | MFCD00008867 |
| SMILES | CC(C)N(C=O)C(C)C |
| Synonym | n,n-diisopropylformamide,formamide, n,n-bis 1-methylethyl,n-formyldiisopropylamine,diisopropylformamide,n,n-bis 1-methylethyl formamide,nn-di-iso-propylformamide,formamide, n,n-diisopropyl,formamide, bis 1-methylethyl,n,n-bis methylethyl carboxamide,1y1&nvhy1&1 |
| IUPAC Name | N,N-di(propan-2-yl)formamide |
| InChI Key | UNBDDZDKBWPHAX-UHFFFAOYSA-N |
| Molecular Formula | C7H15NO |
N,N'-Ethylenebisacrylamide, 96%
CAS: 2956-58-3 Molecular Formula: C8H12N2O2 Molecular Weight (g/mol): 168.196 MDL Number: MFCD00042935 InChI Key: AYGYHGXUJBFUJU-UHFFFAOYSA-N Synonym: n,n'-ethylenebisacrylamide,n,n-ethylenebisacrylamide,ethylene bis acrylamide,n,n'-ethane-1,2-diyl diacrylamide,2-propenamide, n,n'-1,2-ethanediylbis,n,n'-bis acryloyl-1,2-diaminoethane,n,n'-bis acryloyl-1,2-diaminoethane, stabilized with hydroquinone,n-2-prop-2-enoylamino ethyl prop-2-enamide,n-2-prop-2-enamido ethyl prop-2-enamide,ethylenebisacrylamide PubChem CID: 168964 IUPAC Name: N-[2-(prop-2-enoylamino)ethyl]prop-2-enamide SMILES: C=CC(=O)NCCNC(=O)C=C
| PubChem CID | 168964 |
|---|---|
| CAS | 2956-58-3 |
| Molecular Weight (g/mol) | 168.196 |
| MDL Number | MFCD00042935 |
| SMILES | C=CC(=O)NCCNC(=O)C=C |
| Synonym | n,n'-ethylenebisacrylamide,n,n-ethylenebisacrylamide,ethylene bis acrylamide,n,n'-ethane-1,2-diyl diacrylamide,2-propenamide, n,n'-1,2-ethanediylbis,n,n'-bis acryloyl-1,2-diaminoethane,n,n'-bis acryloyl-1,2-diaminoethane, stabilized with hydroquinone,n-2-prop-2-enoylamino ethyl prop-2-enamide,n-2-prop-2-enamido ethyl prop-2-enamide,ethylenebisacrylamide |
| IUPAC Name | N-[2-(prop-2-enoylamino)ethyl]prop-2-enamide |
| InChI Key | AYGYHGXUJBFUJU-UHFFFAOYSA-N |
| Molecular Formula | C8H12N2O2 |