Carboxylic acids and derivatives
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Ethyl 2,3-Butadienoate 95.0+%, TCI America™
CAS: 14369-81-4 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.128 MDL Number: MFCD01863567 InChI Key: GLSUOACRAMLJIW-UHFFFAOYSA-N Synonym: 2,3-Butadienoic Acid Ethyl Ester PubChem CID: 4066088 IUPAC Name: ethyl buta-2,3-dienoate SMILES: CCOC(=O)C=C=C
| PubChem CID | 4066088 |
|---|---|
| CAS | 14369-81-4 |
| Molecular Weight (g/mol) | 112.128 |
| MDL Number | MFCD01863567 |
| SMILES | CCOC(=O)C=C=C |
| Synonym | 2,3-Butadienoic Acid Ethyl Ester |
| IUPAC Name | ethyl buta-2,3-dienoate |
| InChI Key | GLSUOACRAMLJIW-UHFFFAOYSA-N |
| Molecular Formula | C6H8O2 |
Butyl Thioglycolate 98.0+%, TCI America™
CAS: 10047-28-6 Molecular Formula: C6H12O2S Molecular Weight (g/mol): 148.22 MDL Number: MFCD00022087 InChI Key: SKGVGRLWZVRZDC-UHFFFAOYSA-N Synonym: Thioglycolic Acid Butyl Ester, Mercaptoacetic Acid Butyl Ester, Butyl Mercaptoacetate PubChem CID: 82321 IUPAC Name: butyl 2-sulfanylacetate SMILES: CCCCOC(=O)CS
| PubChem CID | 82321 |
|---|---|
| CAS | 10047-28-6 |
| Molecular Weight (g/mol) | 148.22 |
| MDL Number | MFCD00022087 |
| SMILES | CCCCOC(=O)CS |
| Synonym | Thioglycolic Acid Butyl Ester, Mercaptoacetic Acid Butyl Ester, Butyl Mercaptoacetate |
| IUPAC Name | butyl 2-sulfanylacetate |
| InChI Key | SKGVGRLWZVRZDC-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2S |
Ethyl Indole-2-carboxylate 98.0+%, TCI America™
CAS: 3770-50-1 Molecular Formula: C11H11NO2 Molecular Weight (g/mol): 189.21 MDL Number: MFCD00005609 InChI Key: QQXQAEWRSVZPJM-UHFFFAOYSA-N Synonym: ethyl indole-2-carboxylate,indole-2-carboxylic acid ethyl ester,2-carbethoxyindole,1h-indole-2-carboxylic acid, ethyl ester,indole-2-carboxylic acid, ethyl ester,1h-indole-2-carboxylic acid ethyl ester,ethylindole-2-carboxylate,ethyl 2-indolecarboxylate,1h-indole-2-carboxylic acid,ethyl ester,2-carboethoxyindole PubChem CID: 73125 IUPAC Name: ethyl 1H-indole-2-carboxylate SMILES: CCOC(=O)C1=CC2=CC=CC=C2N1
| PubChem CID | 73125 |
|---|---|
| CAS | 3770-50-1 |
| Molecular Weight (g/mol) | 189.21 |
| MDL Number | MFCD00005609 |
| SMILES | CCOC(=O)C1=CC2=CC=CC=C2N1 |
| Synonym | ethyl indole-2-carboxylate,indole-2-carboxylic acid ethyl ester,2-carbethoxyindole,1h-indole-2-carboxylic acid, ethyl ester,indole-2-carboxylic acid, ethyl ester,1h-indole-2-carboxylic acid ethyl ester,ethylindole-2-carboxylate,ethyl 2-indolecarboxylate,1h-indole-2-carboxylic acid,ethyl ester,2-carboethoxyindole |
| IUPAC Name | ethyl 1H-indole-2-carboxylate |
| InChI Key | QQXQAEWRSVZPJM-UHFFFAOYSA-N |
| Molecular Formula | C11H11NO2 |
trans-4-Ethylcyclohexanecarboxylic Acid 98.0+%, TCI America™
CAS: 6833-47-2 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 | 6833-47-2 |
| 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 |
2-(Methylthio)acetamide 98.0+%, TCI America™
CAS: 22551-24-2 Molecular Formula: C3H7NOS Molecular Weight (g/mol): 105.155 MDL Number: MFCD00041321 InChI Key: OBENGAMZEGRSIC-UHFFFAOYSA-N PubChem CID: 547873 IUPAC Name: 2-methylsulfanylacetamide SMILES: CSCC(=O)N
| PubChem CID | 547873 |
|---|---|
| CAS | 22551-24-2 |
| Molecular Weight (g/mol) | 105.155 |
| MDL Number | MFCD00041321 |
| SMILES | CSCC(=O)N |
| IUPAC Name | 2-methylsulfanylacetamide |
| InChI Key | OBENGAMZEGRSIC-UHFFFAOYSA-N |
| Molecular Formula | C3H7NOS |
Ethyl 4,4,4-Trifluorocrotonate 98.0+%, TCI America™
CAS: 25597-16-4 Molecular Formula: C6H7F3O2 Molecular Weight (g/mol): 168.12 MDL Number: MFCD00009903 InChI Key: ZKRJCMKLCDWROR-ONEGZZNKSA-N Synonym: ethyl 4,4,4-trifluorocrotonate,ethyl 2e-4,4,4-trifluorobut-2-enoate,ethyl4,4,4-trifluorocrotonate,e-ethyl 4,4,4-trifluorobut-2-enoate,4,4,4-trifluorocrotonic acid ethyl ester,ethyl e-4,4,4-trifluorobut-2-enoate,ethyl-4,4,4-trifluorocrotonate,ethyl 4,4,4-trifluorobut-2-enoate,4,4,4-trifluoro-but-2-enoic acid ethyl ester,2-butenoic acid, 4,4,4-trifluoro-, ethyl ester, 2e PubChem CID: 5371261 IUPAC Name: ethyl (2E)-4,4,4-trifluorobut-2-enoate SMILES: CCOC(=O)\C=C\C(F)(F)F
| PubChem CID | 5371261 |
|---|---|
| CAS | 25597-16-4 |
| Molecular Weight (g/mol) | 168.12 |
| MDL Number | MFCD00009903 |
| SMILES | CCOC(=O)\C=C\C(F)(F)F |
| Synonym | ethyl 4,4,4-trifluorocrotonate,ethyl 2e-4,4,4-trifluorobut-2-enoate,ethyl4,4,4-trifluorocrotonate,e-ethyl 4,4,4-trifluorobut-2-enoate,4,4,4-trifluorocrotonic acid ethyl ester,ethyl e-4,4,4-trifluorobut-2-enoate,ethyl-4,4,4-trifluorocrotonate,ethyl 4,4,4-trifluorobut-2-enoate,4,4,4-trifluoro-but-2-enoic acid ethyl ester,2-butenoic acid, 4,4,4-trifluoro-, ethyl ester, 2e |
| IUPAC Name | ethyl (2E)-4,4,4-trifluorobut-2-enoate |
| InChI Key | ZKRJCMKLCDWROR-ONEGZZNKSA-N |
| Molecular Formula | C6H7F3O2 |
N-Dodecylacrylamide 97.0+%, TCI America™
CAS: 1506-53-2 Molecular Formula: C15H29NO Molecular Weight (g/mol): 239.40 MDL Number: MFCD08276361 InChI Key: XQPVIMDDIXCFFS-UHFFFAOYSA-N Synonym: n-dodecylacrylamide,2-propenamide,n-dodecyl,acmc-209d4r PubChem CID: 73929 IUPAC Name: N-dodecylprop-2-enamide SMILES: CCCCCCCCCCCCNC(=O)C=C
| PubChem CID | 73929 |
|---|---|
| CAS | 1506-53-2 |
| Molecular Weight (g/mol) | 239.40 |
| MDL Number | MFCD08276361 |
| SMILES | CCCCCCCCCCCCNC(=O)C=C |
| Synonym | n-dodecylacrylamide,2-propenamide,n-dodecyl,acmc-209d4r |
| IUPAC Name | N-dodecylprop-2-enamide |
| InChI Key | XQPVIMDDIXCFFS-UHFFFAOYSA-N |
| Molecular Formula | C15H29NO |
Methyl D-(+)-Lactate 98.0+%, TCI America™
CAS: 17392-83-5 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00004517 InChI Key: LPEKGGXMPWTOCB-UHFFFAOYNA-N Synonym: methyl r-+-lactate,methyl d-lactate,r-methyl 2-hydroxypropanoate,methyl r-lactate,+-methyl d-lactate,methyl 2r-2-hydroxypropanoate,d-lactic acid methyl ester,methyl lactate, +,unii-45mz1t3tbv,r-methyl lactate PubChem CID: 637514 ChEBI: CHEBI:74611 IUPAC Name: methyl 2-hydroxypropanoate SMILES: COC(=O)C(C)O
| PubChem CID | 637514 |
|---|---|
| CAS | 17392-83-5 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:74611 |
| MDL Number | MFCD00004517 |
| SMILES | COC(=O)C(C)O |
| Synonym | methyl r-+-lactate,methyl d-lactate,r-methyl 2-hydroxypropanoate,methyl r-lactate,+-methyl d-lactate,methyl 2r-2-hydroxypropanoate,d-lactic acid methyl ester,methyl lactate, +,unii-45mz1t3tbv,r-methyl lactate |
| IUPAC Name | methyl 2-hydroxypropanoate |
| InChI Key | LPEKGGXMPWTOCB-UHFFFAOYNA-N |
| Molecular Formula | C4H8O3 |
4-Hydroxybenzamide 98.0+%, TCI America™
CAS: 619-57-8 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 MDL Number: MFCD00007997 InChI Key: QXSAKPUBHTZHKW-UHFFFAOYSA-N Synonym: benzamide, 4-hydroxy,4-hydroxy-benzamide,p-hydroxybenzamide,unii-9ou5yd093j,4-hydroxy benzamide,1,3,4,9-tetrahydro-2-hydroxybenzoyl-9-4-hydroxyphenyl methyl-6-methoxy-2h-pyrido 3,4-b indole,4-oxidanylbenzamide,acmc-1apvc,para-hydroxybenzoic amide PubChem CID: 65052 IUPAC Name: 4-hydroxybenzamide SMILES: NC(=O)C1=CC=C(O)C=C1
| PubChem CID | 65052 |
|---|---|
| CAS | 619-57-8 |
| Molecular Weight (g/mol) | 137.14 |
| MDL Number | MFCD00007997 |
| SMILES | NC(=O)C1=CC=C(O)C=C1 |
| Synonym | benzamide, 4-hydroxy,4-hydroxy-benzamide,p-hydroxybenzamide,unii-9ou5yd093j,4-hydroxy benzamide,1,3,4,9-tetrahydro-2-hydroxybenzoyl-9-4-hydroxyphenyl methyl-6-methoxy-2h-pyrido 3,4-b indole,4-oxidanylbenzamide,acmc-1apvc,para-hydroxybenzoic amide |
| IUPAC Name | 4-hydroxybenzamide |
| InChI Key | QXSAKPUBHTZHKW-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO2 |
Propyl Propionate 98.0+%, TCI America™
CAS: 106-36-5 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009373 InChI Key: MCSINKKTEDDPNK-UHFFFAOYSA-N Synonym: propyl propionate,n-propyl propionate,propanoic acid, propyl ester,n-propyl propanoate,propionic acid, propyl ester,n-propyl n-propionate,propylester kyseliny propionove,unii-g09trv00gk,propyl propionate natural,propionic acid n-propyl ester PubChem CID: 7803 IUPAC Name: propyl propanoate SMILES: CCCOC(=O)CC
| PubChem CID | 7803 |
|---|---|
| CAS | 106-36-5 |
| Molecular Weight (g/mol) | 116.16 |
| MDL Number | MFCD00009373 |
| SMILES | CCCOC(=O)CC |
| Synonym | propyl propionate,n-propyl propionate,propanoic acid, propyl ester,n-propyl propanoate,propionic acid, propyl ester,n-propyl n-propionate,propylester kyseliny propionove,unii-g09trv00gk,propyl propionate natural,propionic acid n-propyl ester |
| IUPAC Name | propyl propanoate |
| InChI Key | MCSINKKTEDDPNK-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
4-Pentylcyclohexanecarboxylic Acid (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 38792-89-1 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.306 MDL Number: MFCD00466238 InChI Key: RVLAXPQGTRTHEV-UHFFFAOYSA-N Synonym: 4-Amylcyclohexanecarboxylic Acid PubChem CID: 98882 IUPAC Name: 4-pentylcyclohexane-1-carboxylic acid SMILES: CCCCCC1CCC(CC1)C(=O)O
| PubChem CID | 98882 |
|---|---|
| CAS | 38792-89-1 |
| Molecular Weight (g/mol) | 198.306 |
| MDL Number | MFCD00466238 |
| SMILES | CCCCCC1CCC(CC1)C(=O)O |
| Synonym | 4-Amylcyclohexanecarboxylic Acid |
| IUPAC Name | 4-pentylcyclohexane-1-carboxylic acid |
| InChI Key | RVLAXPQGTRTHEV-UHFFFAOYSA-N |
| Molecular Formula | C12H22O2 |
1,2-Bis(2-aminophenoxy)ethane-N,N,N',N'-tetraacetic Acid 90.0+%, TCI America™
CAS: 85233-19-8 Molecular Formula: C22H24N2O10 Molecular Weight (g/mol): 476.44 MDL Number: MFCD00036255 InChI Key: FTEDXVNDVHYDQW-UHFFFAOYSA-N Synonym: bapta,bapeta,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid,ca ii-bapta,1,2-bis-2-aminophenoxy ethane n,n,n',n'-tetraacetic acid,unii-k22ddw77c0,1,2-bis o-aminophenoxy ethane-n,n,n',n'-tetraacetic acid,bapta tetrasodium salt hydrate,glycine, n,n'-1,2-ethanediylbis oxy-2,1-phenylene bis n-carboxymethyl,2,2',2,2'-ethane-1,2-diylbis oxy-2,1-phenylenenitrilo tetraacetic acid PubChem CID: 104751 ChEBI: CHEBI:60888 IUPAC Name: 2-{[2-(2-{2-[bis(carboxymethyl)amino]phenoxy}ethoxy)phenyl](carboxymethyl)amino}acetic acid SMILES: OC(=O)CN(CC(O)=O)C1=CC=CC=C1OCCOC1=CC=CC=C1N(CC(O)=O)CC(O)=O
| PubChem CID | 104751 |
|---|---|
| CAS | 85233-19-8 |
| Molecular Weight (g/mol) | 476.44 |
| ChEBI | CHEBI:60888 |
| MDL Number | MFCD00036255 |
| SMILES | OC(=O)CN(CC(O)=O)C1=CC=CC=C1OCCOC1=CC=CC=C1N(CC(O)=O)CC(O)=O |
| Synonym | bapta,bapeta,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid,ca ii-bapta,1,2-bis-2-aminophenoxy ethane n,n,n',n'-tetraacetic acid,unii-k22ddw77c0,1,2-bis o-aminophenoxy ethane-n,n,n',n'-tetraacetic acid,bapta tetrasodium salt hydrate,glycine, n,n'-1,2-ethanediylbis oxy-2,1-phenylene bis n-carboxymethyl,2,2',2,2'-ethane-1,2-diylbis oxy-2,1-phenylenenitrilo tetraacetic acid |
| IUPAC Name | 2-{[2-(2-{2-[bis(carboxymethyl)amino]phenoxy}ethoxy)phenyl](carboxymethyl)amino}acetic acid |
| InChI Key | FTEDXVNDVHYDQW-UHFFFAOYSA-N |
| Molecular Formula | C22H24N2O10 |
2,3,4,6-Tetra-O-benzoyl-D-mannopyranose 93.0+%, TCI America™
CAS: 113544-59-5 Molecular Formula: C34H28O10 Molecular Weight (g/mol): 596.59 MDL Number: MFCD02683399 InChI Key: FCDYAJBVISGNLC-UHFFFAOYNA-N PubChem CID: 11146396 IUPAC Name: [3,4,5-tris(benzoyloxy)-6-hydroxyoxan-2-yl]methyl benzoate SMILES: OC1OC(COC(=O)C2=CC=CC=C2)C(OC(=O)C2=CC=CC=C2)C(OC(=O)C2=CC=CC=C2)C1OC(=O)C1=CC=CC=C1
| PubChem CID | 11146396 |
|---|---|
| CAS | 113544-59-5 |
| Molecular Weight (g/mol) | 596.59 |
| MDL Number | MFCD02683399 |
| SMILES | OC1OC(COC(=O)C2=CC=CC=C2)C(OC(=O)C2=CC=CC=C2)C(OC(=O)C2=CC=CC=C2)C1OC(=O)C1=CC=CC=C1 |
| IUPAC Name | [3,4,5-tris(benzoyloxy)-6-hydroxyoxan-2-yl]methyl benzoate |
| InChI Key | FCDYAJBVISGNLC-UHFFFAOYNA-N |
| Molecular Formula | C34H28O10 |
N,N-Diisopropylformamide 98.0+%, TCI America™
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 |