Organic acids and derivatives
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Ethyl (R)-(+)-4-chloro-3-hydroxybutyrate, 97%, ee 96%
CAS: 90866-33-4 Molecular Formula: C6H11ClO3 Molecular Weight (g/mol): 166.601 MDL Number: MFCD00211242 InChI Key: ZAJNMXDBJKCCAT-RXMQYKEDSA-N Synonym: ethyl r-+-4-chloro-3-hydroxybutyrate,r-ethyl 4-chloro-3-hydroxybutanoate,ethyl 3r-4-chloro-3-hydroxybutanoate,ethyl r-4-chloro-3-hydroxybutyrate,ethyl r-+-4-chloro-3-hydroxybutanoate,r-4-chloro-3-hydroxybutyric acid ethyl ester,s-4-chloro-3-hydroxy-butyric acid ethyl ester,r-4-chloro-3-hydroxy-n-butyric acid ethyl ester,ethyl r-4-chloro-3-hydroxybutanoate,butanoic acid, 4-chloro-3-hydroxy-, ethyl ester, 3r PubChem CID: 2734445 IUPAC Name: ethyl (3R)-4-chloro-3-hydroxybutanoate SMILES: CCOC(=O)CC(CCl)O
| PubChem CID | 2734445 |
|---|---|
| CAS | 90866-33-4 |
| Molecular Weight (g/mol) | 166.601 |
| MDL Number | MFCD00211242 |
| SMILES | CCOC(=O)CC(CCl)O |
| Synonym | ethyl r-+-4-chloro-3-hydroxybutyrate,r-ethyl 4-chloro-3-hydroxybutanoate,ethyl 3r-4-chloro-3-hydroxybutanoate,ethyl r-4-chloro-3-hydroxybutyrate,ethyl r-+-4-chloro-3-hydroxybutanoate,r-4-chloro-3-hydroxybutyric acid ethyl ester,s-4-chloro-3-hydroxy-butyric acid ethyl ester,r-4-chloro-3-hydroxy-n-butyric acid ethyl ester,ethyl r-4-chloro-3-hydroxybutanoate,butanoic acid, 4-chloro-3-hydroxy-, ethyl ester, 3r |
| IUPAC Name | ethyl (3R)-4-chloro-3-hydroxybutanoate |
| InChI Key | ZAJNMXDBJKCCAT-RXMQYKEDSA-N |
| Molecular Formula | C6H11ClO3 |
Ethyl (S)-(+)-4-cyano-3-hydroxybutyrate, 97%, ee 98+%
CAS: 312745-91-8 Molecular Formula: C7H11NO3 Molecular Weight (g/mol): 157.17 MDL Number: MFCD00672878 InChI Key: LOQFROBMBSKWQY-UHFFFAOYNA-N Synonym: ethyl s-4-cyano-3-hydroxybutyrate,s-ethyl 4-cyano-3-hydroxybutanoate,ethyl 3s-4-cyano-3-hydroxybutanoate,s-ethyl-4-cyano-3-hydroxybutyrate,ethyl s-+-4-cyano-3-hydroxybutyrate,butanoic acid, 4-cyano-3-hydroxy-, ethyl ester, 3s,4-cyano-3-hydroxy-butyric acid ethyl ester,pubchem21112 PubChem CID: 7020868 IUPAC Name: ethyl (3S)-4-cyano-3-hydroxybutanoate SMILES: CCOC(=O)CC(O)CC#N
| PubChem CID | 7020868 |
|---|---|
| CAS | 312745-91-8 |
| Molecular Weight (g/mol) | 157.17 |
| MDL Number | MFCD00672878 |
| SMILES | CCOC(=O)CC(O)CC#N |
| Synonym | ethyl s-4-cyano-3-hydroxybutyrate,s-ethyl 4-cyano-3-hydroxybutanoate,ethyl 3s-4-cyano-3-hydroxybutanoate,s-ethyl-4-cyano-3-hydroxybutyrate,ethyl s-+-4-cyano-3-hydroxybutyrate,butanoic acid, 4-cyano-3-hydroxy-, ethyl ester, 3s,4-cyano-3-hydroxy-butyric acid ethyl ester,pubchem21112 |
| IUPAC Name | ethyl (3S)-4-cyano-3-hydroxybutanoate |
| InChI Key | LOQFROBMBSKWQY-UHFFFAOYNA-N |
| Molecular Formula | C7H11NO3 |
Sodium Tartrate, Dihydrate, Crystal, Reagent, ACS, 99-101%, Spectrum™ Chemical
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CAS: 6106-24-7 Molecular Formula: C4H8Na2O8 Molecular Weight (g/mol): 230.08 MDL Number: MFCD00150035 InChI Key: FGJLAJMGHXGFDE-UDMGOBQRNA-L IUPAC Name: disodium (2R,3R)-2,3-dihydroxybutanedioate dihydrate SMILES: O.O.[Na+].[Na+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O
| CAS | 6106-24-7 |
|---|---|
| Molecular Weight (g/mol) | 230.08 |
| MDL Number | MFCD00150035 |
| SMILES | O.O.[Na+].[Na+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O |
| IUPAC Name | disodium (2R,3R)-2,3-dihydroxybutanedioate dihydrate |
| InChI Key | FGJLAJMGHXGFDE-UDMGOBQRNA-L |
| Molecular Formula | C4H8Na2O8 |
5-Methyl-1-phenyl-1H-pyrazole-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 91138-00-0 Molecular Formula: C11H10N2O2 Molecular Weight (g/mol): 202.213 InChI Key: USSMIQWDLWJQDQ-UHFFFAOYSA-N Synonym: 5-methyl-1-phenyl-1h-pyrazole-4-carboxylic acid,3-methyl-2-phenylpyrazole-4-carboxylic acid,3-methyl-2-phenyl-4-pyrazolecarboxylic acid,akos pao-0331,acmc-20am2c,rarechem al be 1317,maybridge1_002413,buttpark 33\08-16,cbi-bb zero/006129,5-methyl-1-phenyl-1h-pyrazole-4-carboxylicacid PubChem CID: 145221 IUPAC Name: 5-methyl-1-phenylpyrazole-4-carboxylic acid SMILES: CC1=C(C=NN1C2=CC=CC=C2)C(=O)O
| PubChem CID | 145221 |
|---|---|
| CAS | 91138-00-0 |
| Molecular Weight (g/mol) | 202.213 |
| SMILES | CC1=C(C=NN1C2=CC=CC=C2)C(=O)O |
| Synonym | 5-methyl-1-phenyl-1h-pyrazole-4-carboxylic acid,3-methyl-2-phenylpyrazole-4-carboxylic acid,3-methyl-2-phenyl-4-pyrazolecarboxylic acid,akos pao-0331,acmc-20am2c,rarechem al be 1317,maybridge1_002413,buttpark 33\08-16,cbi-bb zero/006129,5-methyl-1-phenyl-1h-pyrazole-4-carboxylicacid |
| IUPAC Name | 5-methyl-1-phenylpyrazole-4-carboxylic acid |
| InChI Key | USSMIQWDLWJQDQ-UHFFFAOYSA-N |
| Molecular Formula | C11H10N2O2 |
Ethyl 3-ethoxyacrylate, 98%
CAS: 1001-26-9 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00009863 InChI Key: ITQFPVUDTFABDH-AATRIKPKSA-N Synonym: ethyl 3-ethoxyacrylate,e-ethyl 3-ethoxyacrylate,ethyl 3-ethoxy-2-propenoate,ethyl trans-3-ethoxyacrylate,ethyl .beta.-ethoxyacrylate,3-ethoxyacrylic acid ethyl ester,ethyl 2e-3-ethoxyprop-2-enoate,e-3-ethoxy-acrylic acid ethyl ester,ethyl3-ethoxyacrylate,ethyl 3-ethoxypropenoate PubChem CID: 5366269 IUPAC Name: ethyl (E)-3-ethoxyprop-2-enoate SMILES: CCOC=CC(=O)OCC
| PubChem CID | 5366269 |
|---|---|
| CAS | 1001-26-9 |
| Molecular Weight (g/mol) | 144.17 |
| MDL Number | MFCD00009863 |
| SMILES | CCOC=CC(=O)OCC |
| Synonym | ethyl 3-ethoxyacrylate,e-ethyl 3-ethoxyacrylate,ethyl 3-ethoxy-2-propenoate,ethyl trans-3-ethoxyacrylate,ethyl .beta.-ethoxyacrylate,3-ethoxyacrylic acid ethyl ester,ethyl 2e-3-ethoxyprop-2-enoate,e-3-ethoxy-acrylic acid ethyl ester,ethyl3-ethoxyacrylate,ethyl 3-ethoxypropenoate |
| IUPAC Name | ethyl (E)-3-ethoxyprop-2-enoate |
| InChI Key | ITQFPVUDTFABDH-AATRIKPKSA-N |
| Molecular Formula | C7H12O3 |
| CAS | 5118-06-9 |
|---|---|
| MDL Number | MFCD00055642 |
1-Methyl-5-phenyl-1H-pyrazole-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 105994-75-0 Molecular Formula: C11H10N2O2 Molecular Weight (g/mol): 202.213 MDL Number: MFCD04038957 InChI Key: MXGOKNNGBUOAGF-UHFFFAOYSA-N Synonym: 1-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid,1h-pyrazole-4-carboxylicacid, 1-methyl-5-phenyl,acmc-1c8ot,1h-pyrazole-4-carboxylic acid, 1-methyl-5-phenyl,1ff PubChem CID: 2795474 IUPAC Name: 1-methyl-5-phenylpyrazole-4-carboxylic acid SMILES: CN1C(=C(C=N1)C(=O)O)C2=CC=CC=C2
| PubChem CID | 2795474 |
|---|---|
| CAS | 105994-75-0 |
| Molecular Weight (g/mol) | 202.213 |
| MDL Number | MFCD04038957 |
| SMILES | CN1C(=C(C=N1)C(=O)O)C2=CC=CC=C2 |
| Synonym | 1-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid,1h-pyrazole-4-carboxylicacid, 1-methyl-5-phenyl,acmc-1c8ot,1h-pyrazole-4-carboxylic acid, 1-methyl-5-phenyl,1ff |
| IUPAC Name | 1-methyl-5-phenylpyrazole-4-carboxylic acid |
| InChI Key | MXGOKNNGBUOAGF-UHFFFAOYSA-N |
| Molecular Formula | C11H10N2O2 |
ethyle2-amino-5-methyl-4-phenylthiophene-3-carboxylate, 97%, Thermo Scientific™
CAS: 4815-37-6 Molecular Formula: C14H15NO2S Molecular Weight (g/mol): 261.339 MDL Number: MFCD01763475 InChI Key: SXONDAWSQJWZEO-UHFFFAOYSA-N Synonym: 2-amino-5-methyl-4-phenyl-thiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylicacid, 2-amino-5-methyl-4-phenyl-, ethyl ester,maybridge1_000503,upcmld-dp080,upcmld-dp080:001,ethyl 2-amino-5-methyl-4-phenyl-3-thiophenecarboxylate,3-thiophenecarboxylic acid,2-amino-5-methyl-4-phen,2-amino-4-phenyl-5-methylthiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylic acid, 2-amino-5-methyl-4-phenyl-, ethyl ester PubChem CID: 693902 IUPAC Name: ethyl 2-amino-5-methyl-4-phenylthiophene-3-carboxylate SMILES: CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)N
| PubChem CID | 693902 |
|---|---|
| CAS | 4815-37-6 |
| Molecular Weight (g/mol) | 261.339 |
| MDL Number | MFCD01763475 |
| SMILES | CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)N |
| Synonym | 2-amino-5-methyl-4-phenyl-thiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylicacid, 2-amino-5-methyl-4-phenyl-, ethyl ester,maybridge1_000503,upcmld-dp080,upcmld-dp080:001,ethyl 2-amino-5-methyl-4-phenyl-3-thiophenecarboxylate,3-thiophenecarboxylic acid,2-amino-5-methyl-4-phen,2-amino-4-phenyl-5-methylthiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylic acid, 2-amino-5-methyl-4-phenyl-, ethyl ester |
| IUPAC Name | ethyl 2-amino-5-methyl-4-phenylthiophene-3-carboxylate |
| InChI Key | SXONDAWSQJWZEO-UHFFFAOYSA-N |
| Molecular Formula | C14H15NO2S |
Ethyl 3,5-dimethyl-1H-4-pyrazolecarboxylate, 97%, Thermo Scientific™
CAS: 35691-93-1 Molecular Formula: C8H12N2O2 Molecular Weight (g/mol): 168.196 MDL Number: MFCD00159638 InChI Key: BCKARVLFIJPHQU-UHFFFAOYSA-N Synonym: ethyl 3,5-dimethyl-1h-4-pyrazolecarboxylate,ethyl 3,5-dimethylpyrazole-4-carboxylate,3,5-dimethylpyrazole-4-carboxylic acid ethyl ester,3,5-dimethyl-1h-pyrazole-4-carboxylic acid ethyl ester,4-pyrazolecarboxylic acid, 3,5-dimethyl-, ethyl ester,3.5. dimethylpyrazol 4-carbonsaeureaethyl ester german,3.5. dimethylpyrazol 4-carbonsaeureaethyl ester,3,5-dimethyl-4-ethoxycarbonyl-1h-pyrazole,1h-pyrazole-4-carboxylic acid, 3,5-dimethyl-, ethyl ester,dee PubChem CID: 215436 IUPAC Name: ethyl 3,5-dimethyl-1H-pyrazole-4-carboxylate SMILES: CCOC(=O)C1=C(NN=C1C)C
| PubChem CID | 215436 |
|---|---|
| CAS | 35691-93-1 |
| Molecular Weight (g/mol) | 168.196 |
| MDL Number | MFCD00159638 |
| SMILES | CCOC(=O)C1=C(NN=C1C)C |
| Synonym | ethyl 3,5-dimethyl-1h-4-pyrazolecarboxylate,ethyl 3,5-dimethylpyrazole-4-carboxylate,3,5-dimethylpyrazole-4-carboxylic acid ethyl ester,3,5-dimethyl-1h-pyrazole-4-carboxylic acid ethyl ester,4-pyrazolecarboxylic acid, 3,5-dimethyl-, ethyl ester,3.5. dimethylpyrazol 4-carbonsaeureaethyl ester german,3.5. dimethylpyrazol 4-carbonsaeureaethyl ester,3,5-dimethyl-4-ethoxycarbonyl-1h-pyrazole,1h-pyrazole-4-carboxylic acid, 3,5-dimethyl-, ethyl ester,dee |
| IUPAC Name | ethyl 3,5-dimethyl-1H-pyrazole-4-carboxylate |
| InChI Key | BCKARVLFIJPHQU-UHFFFAOYSA-N |
| Molecular Formula | C8H12N2O2 |
Cholesteryl nonanoate, Thermo Scientific Chemicals
CAS: 1182-66-7 Molecular Formula: C36H62O2 Molecular Weight (g/mol): 526.89 MDL Number: MFCD00003643 InChI Key: WCLNGBQPTVENHV-MKQVXYPISA-N Synonym: cholesteryl pelargonate,cholesteryl nonanoate,cholesterol pelargonate,unii-4313o7p4xw,5-cholesten-3beta-ol 3-nonanoate,cholesterol, nonanoate,3beta-hydroxy-5-cholestene 3-nonanoate,nonanoic acid cholesterol ester,pelargonic acid cholesterol ester,cholest-5-ene-3-beta-yl nonanoate PubChem CID: 2723614 IUPAC Name: [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] nonanoate SMILES: CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C
| PubChem CID | 2723614 |
|---|---|
| CAS | 1182-66-7 |
| Molecular Weight (g/mol) | 526.89 |
| MDL Number | MFCD00003643 |
| SMILES | CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C |
| Synonym | cholesteryl pelargonate,cholesteryl nonanoate,cholesterol pelargonate,unii-4313o7p4xw,5-cholesten-3beta-ol 3-nonanoate,cholesterol, nonanoate,3beta-hydroxy-5-cholestene 3-nonanoate,nonanoic acid cholesterol ester,pelargonic acid cholesterol ester,cholest-5-ene-3-beta-yl nonanoate |
| IUPAC Name | [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] nonanoate |
| InChI Key | WCLNGBQPTVENHV-MKQVXYPISA-N |
| Molecular Formula | C36H62O2 |
Triethylenetetramine-N,N,N',N″,N‴,N‴-hexaacetic acid, 98%
CAS: 869-52-3 Molecular Formula: C18H30N4O12 Molecular Weight (g/mol): 494.454 MDL Number: MFCD00004290 InChI Key: RAEOEMDZDMCHJA-UHFFFAOYSA-N Synonym: ttha,hexaacetic acid,triethylenetetraminehexaacetate,3,6,9,12-tetraazatetradecanedioic acid, 3,6,9,12-tetrakis carboxymethyl,triethylenetetranitrilohexaacetic acid,triethylenetetramine-n,n,n',n,n',n'-hexaacetic acid,triethylenetetramine-n,n,n',n',n,n-hexaacetic acid,triethylenetetramine-n,n,n',n,n',3,6,9,12-tetrakis carboxymethyl-3,6,9,12-tetraazatetradecanedioic acid,3,6,9,12-tetrakis carboxymethyl-3,6,9,12-tetraazatetradecane-1,14-dioic acid PubChem CID: 70088 IUPAC Name: 2-[2-[bis(carboxymethyl)amino]ethyl-[2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]ethyl]amino]acetic acid SMILES: C(CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O
| PubChem CID | 70088 |
|---|---|
| CAS | 869-52-3 |
| Molecular Weight (g/mol) | 494.454 |
| MDL Number | MFCD00004290 |
| SMILES | C(CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O |
| Synonym | ttha,hexaacetic acid,triethylenetetraminehexaacetate,3,6,9,12-tetraazatetradecanedioic acid, 3,6,9,12-tetrakis carboxymethyl,triethylenetetranitrilohexaacetic acid,triethylenetetramine-n,n,n',n,n',n'-hexaacetic acid,triethylenetetramine-n,n,n',n',n,n-hexaacetic acid,triethylenetetramine-n,n,n',n,n',3,6,9,12-tetrakis carboxymethyl-3,6,9,12-tetraazatetradecanedioic acid,3,6,9,12-tetrakis carboxymethyl-3,6,9,12-tetraazatetradecane-1,14-dioic acid |
| IUPAC Name | 2-[2-[bis(carboxymethyl)amino]ethyl-[2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]ethyl]amino]acetic acid |
| InChI Key | RAEOEMDZDMCHJA-UHFFFAOYSA-N |
| Molecular Formula | C18H30N4O12 |
Phenylpropiolic acid, 98+%
CAS: 637-44-5 Molecular Formula: C9H6O2 Molecular Weight (g/mol): 146.15 MDL Number: MFCD00004361 InChI Key: XNERWVPQCYSMLC-UHFFFAOYSA-N Synonym: phenylpropiolic acid,3-phenylpropiolic acid,phenylpropynoic acid,3-phenylpropynoic acid,2-propynoic acid, 3-phenyl,phenylacetylenecarboxylic acid,3-phenyl-2-propynoic acid,phenylacetylene monocarboxylic acid,propiolic acid, 3-phenyl,phenyl propiolic acid PubChem CID: 69475 IUPAC Name: 3-phenylprop-2-ynoic acid SMILES: OC(=O)C#CC1=CC=CC=C1
| PubChem CID | 69475 |
|---|---|
| CAS | 637-44-5 |
| Molecular Weight (g/mol) | 146.15 |
| MDL Number | MFCD00004361 |
| SMILES | OC(=O)C#CC1=CC=CC=C1 |
| Synonym | phenylpropiolic acid,3-phenylpropiolic acid,phenylpropynoic acid,3-phenylpropynoic acid,2-propynoic acid, 3-phenyl,phenylacetylenecarboxylic acid,3-phenyl-2-propynoic acid,phenylacetylene monocarboxylic acid,propiolic acid, 3-phenyl,phenyl propiolic acid |
| IUPAC Name | 3-phenylprop-2-ynoic acid |
| InChI Key | XNERWVPQCYSMLC-UHFFFAOYSA-N |
| Molecular Formula | C9H6O2 |
1-(4-chlorophenyl)-5-methyl-1H-pyrazole-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 187998-35-2 Molecular Formula: C11H9ClN2O2 Molecular Weight (g/mol): 236.655 MDL Number: MFCD01566260 InChI Key: OAPQKGGVDCZENK-UHFFFAOYSA-N PubChem CID: 2777166 IUPAC Name: 1-(4-chlorophenyl)-5-methylpyrazole-4-carboxylic acid SMILES: CC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)O
| PubChem CID | 2777166 |
|---|---|
| CAS | 187998-35-2 |
| Molecular Weight (g/mol) | 236.655 |
| MDL Number | MFCD01566260 |
| SMILES | CC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)O |
| IUPAC Name | 1-(4-chlorophenyl)-5-methylpyrazole-4-carboxylic acid |
| InChI Key | OAPQKGGVDCZENK-UHFFFAOYSA-N |
| Molecular Formula | C11H9ClN2O2 |
4-Acryloylmorpholine, 97%
CAS: 5117-12-4 Molecular Formula: C7H11NO2 Molecular Weight (g/mol): 141.17 InChI Key: XLPJNCYCZORXHG-UHFFFAOYSA-N SMILES: C=CC(=O)N1CCOCC1
| CAS | 5117-12-4 |
|---|---|
| Molecular Weight (g/mol) | 141.17 |
| SMILES | C=CC(=O)N1CCOCC1 |
| InChI Key | XLPJNCYCZORXHG-UHFFFAOYSA-N |
| Molecular Formula | C7H11NO2 |
Ethyl 3-amino-1H-pyrazole-4-carboxylate, 99%
CAS: 6994-25-8 Molecular Formula: C6H9N3O2 Molecular Weight (g/mol): 155.157 MDL Number: MFCD00005238 InChI Key: YPXGHKWOJXQLQU-UHFFFAOYSA-N Synonym: ethyl 3-amino-1h-pyrazole-4-carboxylate,ethyl 3-amino-4-pyrazolecarboxylate,3-amino-4-carbethoxypyrazole,5-amino-1h-pyrazole-4-carboxylic acid ethyl ester,3-amino-1h-pyrazole-4-carboxylic acid ethyl ester,ethyl 3-aminopyrazole-4-carboxylate,3-amino-4-ethoxycarbonylpyrazole,unii-9gy5ha1gaa,3-amino-4-carbethoxypyrazol,1h-pyrazole-4-carboxylic acid, 3-amino-, ethyl ester PubChem CID: 81472 IUPAC Name: ethyl 5-amino-1H-pyrazole-4-carboxylate SMILES: CCOC(=O)C1=C(NN=C1)N
| PubChem CID | 81472 |
|---|---|
| CAS | 6994-25-8 |
| Molecular Weight (g/mol) | 155.157 |
| MDL Number | MFCD00005238 |
| SMILES | CCOC(=O)C1=C(NN=C1)N |
| Synonym | ethyl 3-amino-1h-pyrazole-4-carboxylate,ethyl 3-amino-4-pyrazolecarboxylate,3-amino-4-carbethoxypyrazole,5-amino-1h-pyrazole-4-carboxylic acid ethyl ester,3-amino-1h-pyrazole-4-carboxylic acid ethyl ester,ethyl 3-aminopyrazole-4-carboxylate,3-amino-4-ethoxycarbonylpyrazole,unii-9gy5ha1gaa,3-amino-4-carbethoxypyrazol,1h-pyrazole-4-carboxylic acid, 3-amino-, ethyl ester |
| IUPAC Name | ethyl 5-amino-1H-pyrazole-4-carboxylate |
| InChI Key | YPXGHKWOJXQLQU-UHFFFAOYSA-N |
| Molecular Formula | C6H9N3O2 |