Organic acids and derivatives
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Diethyl Ethoxymethylenemalonate 98.0+%, TCI America™
CAS: 87-13-8 Molecular Formula: C10H16O5 Molecular Weight (g/mol): 216.233 MDL Number: MFCD00009148 InChI Key: LTMHNWPUDSTBKD-UHFFFAOYSA-N Synonym: diethyl ethoxymethylenemalonate,diethyl 2-ethoxymethylene malonate,ethoxymethylenemalonic acid diethyl ester,diethyl ethoxymethylene malonate,diethyl emme,propanedioic acid, ethoxymethylene-, diethyl ester,diethylethoxymethylenemalonate,1,3-diethyl 2-ethoxymethylidene propanedioate,diethyl ethoxymethylidene propanedioate PubChem CID: 6871 IUPAC Name: diethyl 2-(ethoxymethylidene)propanedioate SMILES: CCOC=C(C(=O)OCC)C(=O)OCC
| PubChem CID | 6871 |
|---|---|
| CAS | 87-13-8 |
| Molecular Weight (g/mol) | 216.233 |
| MDL Number | MFCD00009148 |
| SMILES | CCOC=C(C(=O)OCC)C(=O)OCC |
| Synonym | diethyl ethoxymethylenemalonate,diethyl 2-ethoxymethylene malonate,ethoxymethylenemalonic acid diethyl ester,diethyl ethoxymethylene malonate,diethyl emme,propanedioic acid, ethoxymethylene-, diethyl ester,diethylethoxymethylenemalonate,1,3-diethyl 2-ethoxymethylidene propanedioate,diethyl ethoxymethylidene propanedioate |
| IUPAC Name | diethyl 2-(ethoxymethylidene)propanedioate |
| InChI Key | LTMHNWPUDSTBKD-UHFFFAOYSA-N |
| Molecular Formula | C10H16O5 |
Ethyl DL-Leucate 98.0+%, TCI America™
CAS: 10348-47-7 Molecular Formula: C8H16O3 Molecular Weight (g/mol): 160.213 InChI Key: QRHOWVDPHIXNEN-UHFFFAOYSA-N Synonym: DL-Leucic Acid Ethyl Ester, Ethyl DL-2-Hydroxy-4-methylvalerate, DL-2-Hydroxy-4-methylvaleric Acid Ethyl Ester PubChem CID: 112030 IUPAC Name: ethyl 2-hydroxy-4-methylpentanoate SMILES: CCOC(=O)C(CC(C)C)O
| PubChem CID | 112030 |
|---|---|
| CAS | 10348-47-7 |
| Molecular Weight (g/mol) | 160.213 |
| SMILES | CCOC(=O)C(CC(C)C)O |
| Synonym | DL-Leucic Acid Ethyl Ester, Ethyl DL-2-Hydroxy-4-methylvalerate, DL-2-Hydroxy-4-methylvaleric Acid Ethyl Ester |
| IUPAC Name | ethyl 2-hydroxy-4-methylpentanoate |
| InChI Key | QRHOWVDPHIXNEN-UHFFFAOYSA-N |
| Molecular Formula | C8H16O3 |
Ethyl Indole-3-carboxylate 97.0+%, TCI America™
CAS: 776-41-0 Molecular Formula: C11H11NO2 Molecular Weight (g/mol): 189.214 MDL Number: MFCD00228454 InChI Key: XOUHVMVYFOXTMN-UHFFFAOYSA-N Synonym: ethyl indole-3-carboxylate,indole-3-carboxylic acid ethyl ester,1h-indole-3-carboxylic acid ethyl ester,1h-indole-3-carboxylic acid, ethyl ester,indole3carboxylicacidethylester,pubchem7352,lindole-3-ethyl formate,3-ethoxycarbonyl indole,ksc644o3d,3-indolecarboxylicacidethylester PubChem CID: 247965 IUPAC Name: ethyl 1H-indole-3-carboxylate SMILES: CCOC(=O)C1=CNC2=CC=CC=C21
| PubChem CID | 247965 |
|---|---|
| CAS | 776-41-0 |
| Molecular Weight (g/mol) | 189.214 |
| MDL Number | MFCD00228454 |
| SMILES | CCOC(=O)C1=CNC2=CC=CC=C21 |
| Synonym | ethyl indole-3-carboxylate,indole-3-carboxylic acid ethyl ester,1h-indole-3-carboxylic acid ethyl ester,1h-indole-3-carboxylic acid, ethyl ester,indole3carboxylicacidethylester,pubchem7352,lindole-3-ethyl formate,3-ethoxycarbonyl indole,ksc644o3d,3-indolecarboxylicacidethylester |
| IUPAC Name | ethyl 1H-indole-3-carboxylate |
| InChI Key | XOUHVMVYFOXTMN-UHFFFAOYSA-N |
| Molecular Formula | C11H11NO2 |
Isoamyl Formate 95.0+%, TCI America™
CAS: 110-45-2 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00021049 InChI Key: XKYICAQFSCFURC-UHFFFAOYSA-N Synonym: Formic Acid Isoamyl Ester PubChem CID: 8052 ChEBI: CHEBI:31726 IUPAC Name: 3-methylbutyl formate SMILES: CC(C)CCOC=O
| PubChem CID | 8052 |
|---|---|
| CAS | 110-45-2 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:31726 |
| MDL Number | MFCD00021049 |
| SMILES | CC(C)CCOC=O |
| Synonym | Formic Acid Isoamyl Ester |
| IUPAC Name | 3-methylbutyl formate |
| InChI Key | XKYICAQFSCFURC-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
Ethyl Formate 98.0+%, TCI America™
CAS: 109-94-4 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.08 MDL Number: MFCD00003294 InChI Key: WBJINCZRORDGAQ-UHFFFAOYSA-N Synonym: areginal,formic acid, ethyl ester,ethyl methanoate,formic acid ethyl ester,aethylformiat,ethyl formic ester,ethylformate,ethylformiaat,formic ether,ethylformiat PubChem CID: 8025 ChEBI: CHEBI:52342 IUPAC Name: ethyl formate SMILES: CCOC=O
| PubChem CID | 8025 |
|---|---|
| CAS | 109-94-4 |
| Molecular Weight (g/mol) | 74.08 |
| ChEBI | CHEBI:52342 |
| MDL Number | MFCD00003294 |
| SMILES | CCOC=O |
| Synonym | areginal,formic acid, ethyl ester,ethyl methanoate,formic acid ethyl ester,aethylformiat,ethyl formic ester,ethylformate,ethylformiaat,formic ether,ethylformiat |
| IUPAC Name | ethyl formate |
| InChI Key | WBJINCZRORDGAQ-UHFFFAOYSA-N |
| Molecular Formula | C3H6O2 |
Ethyl 3-Ethoxyacrylate (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 1001-26-9 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00009863 InChI Key: ITQFPVUDTFABDH-AATRIKPKSA-N 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 |
| IUPAC Name | ethyl (E)-3-ethoxyprop-2-enoate |
| InChI Key | ITQFPVUDTFABDH-AATRIKPKSA-N |
| Molecular Formula | C7H12O3 |
Propyl Formate 95.0+%, TCI America™
CAS: 110-74-7 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.106 MDL Number: MFCD00003295 InChI Key: KFNNIILCVOLYIR-UHFFFAOYSA-N Synonym: formic acid, propyl ester,n-propyl formate,propyl methanoate,formiate de propyle,formic acid propyl ester,propylester kyseliny mravenci,unii-wo1arv6gtw,formiate de propyle french,fema no. 2943,wo1arv6gtw PubChem CID: 8073 IUPAC Name: propyl formate SMILES: CCCOC=O
| PubChem CID | 8073 |
|---|---|
| CAS | 110-74-7 |
| Molecular Weight (g/mol) | 88.106 |
| MDL Number | MFCD00003295 |
| SMILES | CCCOC=O |
| Synonym | formic acid, propyl ester,n-propyl formate,propyl methanoate,formiate de propyle,formic acid propyl ester,propylester kyseliny mravenci,unii-wo1arv6gtw,formiate de propyle french,fema no. 2943,wo1arv6gtw |
| IUPAC Name | propyl formate |
| InChI Key | KFNNIILCVOLYIR-UHFFFAOYSA-N |
| Molecular Formula | C4H8O2 |
Diisopropyl Hydrazine-1,2-dicarboxylate 98.0+%, TCI America™
CAS: 19740-72-8 Molecular Formula: C8H16N2O4 Molecular Weight (g/mol): 204.23 MDL Number: MFCD19443326 InChI Key: FBZULTVJWVCJQV-UHFFFAOYSA-N Synonym: Hydrazine-1,2-dicarboxylic Acid Diisopropyl Ester PubChem CID: 88220 IUPAC Name: N'-[(propan-2-yloxy)carbonyl](propan-2-yloxy)carbohydrazide SMILES: CC(C)OC(=O)NNC(=O)OC(C)C
| PubChem CID | 88220 |
|---|---|
| CAS | 19740-72-8 |
| Molecular Weight (g/mol) | 204.23 |
| MDL Number | MFCD19443326 |
| SMILES | CC(C)OC(=O)NNC(=O)OC(C)C |
| Synonym | Hydrazine-1,2-dicarboxylic Acid Diisopropyl Ester |
| IUPAC Name | N'-[(propan-2-yloxy)carbonyl](propan-2-yloxy)carbohydrazide |
| InChI Key | FBZULTVJWVCJQV-UHFFFAOYSA-N |
| Molecular Formula | C8H16N2O4 |
Ethyl 10-Undecenoate 97.0+%, TCI America™
CAS: 692-86-4 Molecular Formula: C13H24O2 Molecular Weight (g/mol): 212.333 MDL Number: MFCD00009220 InChI Key: FXNFFCMITPHEIT-UHFFFAOYSA-N Synonym: 10-Undecenoic Acid Ethyl Ester PubChem CID: 12729 IUPAC Name: ethyl undec-10-enoate SMILES: CCOC(=O)CCCCCCCCC=C
| PubChem CID | 12729 |
|---|---|
| CAS | 692-86-4 |
| Molecular Weight (g/mol) | 212.333 |
| MDL Number | MFCD00009220 |
| SMILES | CCOC(=O)CCCCCCCCC=C |
| Synonym | 10-Undecenoic Acid Ethyl Ester |
| IUPAC Name | ethyl undec-10-enoate |
| InChI Key | FXNFFCMITPHEIT-UHFFFAOYSA-N |
| Molecular Formula | C13H24O2 |
4-Ethylcyclohexanecarboxylic Acid (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 91328-77-7 Molecular Formula: C9H16O2 Molecular Weight (g/mol): 156.23 MDL Number: MFCD01076323,MFCD01568857 InChI Key: UNROFSAOTBVBBT-UHFFFAOYSA-N Synonym: trans-4-ethylcyclohexanecarboxylic acid,4-ethylcyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 4-ethyl,4-trans-ethyl cyclohexane carboxylic acid,cyclohexanecarboxylic acid, 4-ethyl-, trans,1s,4r-4-ethylcyclohexane-1-carboxylic acid,pubchem2491,acmc-209o2z,ksc352s1t,ksc352s2b PubChem CID: 1490288 IUPAC Name: 4-ethylcyclohexane-1-carboxylic acid SMILES: CCC1CCC(CC1)C(O)=O
| PubChem CID | 1490288 |
|---|---|
| CAS | 91328-77-7 |
| Molecular Weight (g/mol) | 156.23 |
| MDL Number | MFCD01076323,MFCD01568857 |
| SMILES | CCC1CCC(CC1)C(O)=O |
| Synonym | trans-4-ethylcyclohexanecarboxylic acid,4-ethylcyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 4-ethyl,4-trans-ethyl cyclohexane carboxylic acid,cyclohexanecarboxylic acid, 4-ethyl-, trans,1s,4r-4-ethylcyclohexane-1-carboxylic acid,pubchem2491,acmc-209o2z,ksc352s1t,ksc352s2b |
| IUPAC Name | 4-ethylcyclohexane-1-carboxylic acid |
| InChI Key | UNROFSAOTBVBBT-UHFFFAOYSA-N |
| Molecular Formula | C9H16O2 |
Ethyl 3-Aminopyrazole-4-carboxylate 98.0+%, TCI America™
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 |
Ethyl 2-Methyl-4-pentenoate 98.0+%, TCI America™
CAS: 53399-81-8 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00010235 InChI Key: BDBGKYIBDXAVMX-UHFFFAOYNA-N Synonym: ethyl 2-methyl-4-pentenoate,2-methyl-4-pentenoic acid ethyl ester,ethyl 2-methyl 4-pentenoate,4-pentenoic acid, 2-methyl-, ethyl ester,ethyl 2-methylpent-4-en-1-oate,ethyl 2-methyl-4-pentanoate,fema no. 3489,pineapple pentenoate,acmc-1ao14,ethyl-2-methyl-4-pentenoate PubChem CID: 62024 IUPAC Name: ethyl 2-methylpent-4-enoate SMILES: CCOC(=O)C(C)CC=C
| PubChem CID | 62024 |
|---|---|
| CAS | 53399-81-8 |
| Molecular Weight (g/mol) | 142.20 |
| MDL Number | MFCD00010235 |
| SMILES | CCOC(=O)C(C)CC=C |
| Synonym | ethyl 2-methyl-4-pentenoate,2-methyl-4-pentenoic acid ethyl ester,ethyl 2-methyl 4-pentenoate,4-pentenoic acid, 2-methyl-, ethyl ester,ethyl 2-methylpent-4-en-1-oate,ethyl 2-methyl-4-pentanoate,fema no. 3489,pineapple pentenoate,acmc-1ao14,ethyl-2-methyl-4-pentenoate |
| IUPAC Name | ethyl 2-methylpent-4-enoate |
| InChI Key | BDBGKYIBDXAVMX-UHFFFAOYNA-N |
| Molecular Formula | C8H14O2 |
Ethyl 4-Phenylbutyrate 98.0+%, TCI America™
CAS: 10031-93-3 Molecular Formula: C12H16O2 Molecular Weight (g/mol): 192.258 MDL Number: MFCD00026923 InChI Key: GGFNXKFGVQQNRV-UHFFFAOYSA-N Synonym: 4-Phenylbutyric Acid Ethyl Ester PubChem CID: 61452 IUPAC Name: ethyl 4-phenylbutanoate SMILES: CCOC(=O)CCCC1=CC=CC=C1
| PubChem CID | 61452 |
|---|---|
| CAS | 10031-93-3 |
| Molecular Weight (g/mol) | 192.258 |
| MDL Number | MFCD00026923 |
| SMILES | CCOC(=O)CCCC1=CC=CC=C1 |
| Synonym | 4-Phenylbutyric Acid Ethyl Ester |
| IUPAC Name | ethyl 4-phenylbutanoate |
| InChI Key | GGFNXKFGVQQNRV-UHFFFAOYSA-N |
| Molecular Formula | C12H16O2 |
Butyl Formate 95.0+%, TCI America™
CAS: 592-84-7 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.13 MDL Number: MFCD00003296 InChI Key: NMJJFJNHVMGPGM-UHFFFAOYSA-N Synonym: n-butyl formate,formic acid, butyl ester,butyl methanoate,n-butyl methanoate,formic acid butyl ester,n-butylformate,butylester kyseliny mravenci,fema no. 2196,unii-0y9mz7vm9p,butylester kyseliny mravenci czech PubChem CID: 11614 IUPAC Name: butyl formate SMILES: CCCCOC=O
| PubChem CID | 11614 |
|---|---|
| CAS | 592-84-7 |
| Molecular Weight (g/mol) | 102.13 |
| MDL Number | MFCD00003296 |
| SMILES | CCCCOC=O |
| Synonym | n-butyl formate,formic acid, butyl ester,butyl methanoate,n-butyl methanoate,formic acid butyl ester,n-butylformate,butylester kyseliny mravenci,fema no. 2196,unii-0y9mz7vm9p,butylester kyseliny mravenci czech |
| IUPAC Name | butyl formate |
| InChI Key | NMJJFJNHVMGPGM-UHFFFAOYSA-N |
| Molecular Formula | C5H10O2 |
2-Ethyl-4-hydroxy-5-methyl-3(2H)-furanone 97.0+%, TCI America™
CAS: 27538-10-9 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.15 MDL Number: MFCD00191360 InChI Key: GWCRPYGYVRXVLI-UHFFFAOYNA-N PubChem CID: 33931 IUPAC Name: 2-ethyl-4-hydroxy-5-methyl-2,3-dihydrofuran-3-one SMILES: CCC1OC(C)=C(O)C1=O
| PubChem CID | 33931 |
|---|---|
| CAS | 27538-10-9 |
| Molecular Weight (g/mol) | 142.15 |
| MDL Number | MFCD00191360 |
| SMILES | CCC1OC(C)=C(O)C1=O |
| IUPAC Name | 2-ethyl-4-hydroxy-5-methyl-2,3-dihydrofuran-3-one |
| InChI Key | GWCRPYGYVRXVLI-UHFFFAOYNA-N |
| Molecular Formula | C7H10O3 |