Organic acids and derivatives
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4-Hexyloxyphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 121219-08-7 Molecular Formula: C12H19BO3 MDL Number: MFCD04039027 InChI Key: XYNVLFGOOWUKQS-UHFFFAOYSA-N PubChem CID: 3682148
| PubChem CID | 3682148 |
|---|---|
| CAS | 121219-08-7 |
| MDL Number | MFCD04039027 |
| InChI Key | XYNVLFGOOWUKQS-UHFFFAOYSA-N |
| Molecular Formula | C12H19BO3 |
2,2,3,3,3-Pentafluoropropyl p-Toluenesulfonate 98.0+%, TCI America™
CAS: 565-42-4 Molecular Formula: C10H9F5O3S Molecular Weight (g/mol): 304.23 MDL Number: MFCD02093346 InChI Key: JBHQQXONFHOEQU-UHFFFAOYSA-N Synonym: p-Toluenesulfonic Acid 2,2,3,3,3-Pentafluoropropyl Ester, 2,2,3,3,3-Pentafluoropropyl Tosylate PubChem CID: 2776017 IUPAC Name: 2,2,3,3,3-pentafluoropropyl 4-methylbenzene-1-sulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC(F)(F)C(F)(F)F
| PubChem CID | 2776017 |
|---|---|
| CAS | 565-42-4 |
| Molecular Weight (g/mol) | 304.23 |
| MDL Number | MFCD02093346 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCC(F)(F)C(F)(F)F |
| Synonym | p-Toluenesulfonic Acid 2,2,3,3,3-Pentafluoropropyl Ester, 2,2,3,3,3-Pentafluoropropyl Tosylate |
| IUPAC Name | 2,2,3,3,3-pentafluoropropyl 4-methylbenzene-1-sulfonate |
| InChI Key | JBHQQXONFHOEQU-UHFFFAOYSA-N |
| Molecular Formula | C10H9F5O3S |
2',5'-Dichloroacetanilide 98.0+%, TCI America™
CAS: 2621-62-7 Molecular Formula: C8H7Cl2NO Molecular Weight (g/mol): 204.05 MDL Number: MFCD00018519 InChI Key: ICZFWTSENFTULW-UHFFFAOYSA-N PubChem CID: 17494 IUPAC Name: N-(2,5-dichlorophenyl)acetamide SMILES: CC(=O)NC1=C(C=CC(=C1)Cl)Cl
| PubChem CID | 17494 |
|---|---|
| CAS | 2621-62-7 |
| Molecular Weight (g/mol) | 204.05 |
| MDL Number | MFCD00018519 |
| SMILES | CC(=O)NC1=C(C=CC(=C1)Cl)Cl |
| IUPAC Name | N-(2,5-dichlorophenyl)acetamide |
| InChI Key | ICZFWTSENFTULW-UHFFFAOYSA-N |
| Molecular Formula | C8H7Cl2NO |
alpha-Cyclohexylphenylacetic Acid 95.0+%, TCI America™
CAS: 3894-09-5 Molecular Formula: C14H17O2 Molecular Weight (g/mol): 217.29 MDL Number: MFCD00001477 InChI Key: AAJLPPDFIRPBDA-ZDUSSCGKSA-M Synonym: 2-Cyclohexyl-2-phenylacetic Acid PubChem CID: 97942 IUPAC Name: 2-cyclohexyl-2-phenylacetic acid SMILES: C1CCC(CC1)C(C2=CC=CC=C2)C(=O)O
| PubChem CID | 97942 |
|---|---|
| CAS | 3894-09-5 |
| Molecular Weight (g/mol) | 217.29 |
| MDL Number | MFCD00001477 |
| SMILES | C1CCC(CC1)C(C2=CC=CC=C2)C(=O)O |
| Synonym | 2-Cyclohexyl-2-phenylacetic Acid |
| IUPAC Name | 2-cyclohexyl-2-phenylacetic acid |
| InChI Key | AAJLPPDFIRPBDA-ZDUSSCGKSA-M |
| Molecular Formula | C14H17O2 |
Diethyl L-(+)-Tartrate 98.0+%, TCI America™
CAS: 87-91-2 Molecular Formula: C8H14O6 Molecular Weight (g/mol): 206.19 MDL Number: MFCD00009143 InChI Key: YSAVZVORKRDODB-UHFFFAOYNA-N Synonym: diethyl l-+-tartrate,2r,3r-diethyl 2,3-dihydroxysuccinate,l +-diethyl l-tartrate,+-diethyl l-tartrate,diethyl l-tartrate,diethyl-l-tartrate,unii-oq72cpy58z,l-+-tartaric acid diethyl ester,diethyl l-tartarate,tartaric acid, diethyl ester, r,r PubChem CID: 6993580 IUPAC Name: 1,4-diethyl 2,3-dihydroxybutanedioate SMILES: CCOC(=O)C(O)C(O)C(=O)OCC
| PubChem CID | 6993580 |
|---|---|
| CAS | 87-91-2 |
| Molecular Weight (g/mol) | 206.19 |
| MDL Number | MFCD00009143 |
| SMILES | CCOC(=O)C(O)C(O)C(=O)OCC |
| Synonym | diethyl l-+-tartrate,2r,3r-diethyl 2,3-dihydroxysuccinate,l +-diethyl l-tartrate,+-diethyl l-tartrate,diethyl l-tartrate,diethyl-l-tartrate,unii-oq72cpy58z,l-+-tartaric acid diethyl ester,diethyl l-tartarate,tartaric acid, diethyl ester, r,r |
| IUPAC Name | 1,4-diethyl 2,3-dihydroxybutanedioate |
| InChI Key | YSAVZVORKRDODB-UHFFFAOYNA-N |
| Molecular Formula | C8H14O6 |
cis-3-Hexen-1-yl Hexanoate 98.0+%, TCI America™
CAS: 31501-11-8 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.31 MDL Number: MFCD00036552,MFCD00036552 InChI Key: RGACQXBDYBCJCY-ALCCZGGFSA-N Synonym: Hexanoic Acid cis-3-Hexen-1-yl Ester PubChem CID: 5352543 IUPAC Name: (3Z)-hex-3-en-1-yl hexanoate SMILES: CCCCCC(=O)OCC\C=C/CC
| PubChem CID | 5352543 |
|---|---|
| CAS | 31501-11-8 |
| Molecular Weight (g/mol) | 198.31 |
| MDL Number | MFCD00036552,MFCD00036552 |
| SMILES | CCCCCC(=O)OCC\C=C/CC |
| Synonym | Hexanoic Acid cis-3-Hexen-1-yl Ester |
| IUPAC Name | (3Z)-hex-3-en-1-yl hexanoate |
| InChI Key | RGACQXBDYBCJCY-ALCCZGGFSA-N |
| Molecular Formula | C12H22O2 |
Vinyl Chloroacetate (stabilized with MEHQ) 99.0+%, TCI America™
CAS: 2549-51-1 Molecular Formula: C4H5ClO2 Molecular Weight (g/mol): 120.532 MDL Number: MFCD00045275 InChI Key: XJELOQYISYPGDX-UHFFFAOYSA-N Synonym: vinyl chloroacetate,acetic acid, chloro-, ethenyl ester,acetic acid, 2-chloro-, ethenyl ester,acetic acid, chloro-, vinyl ester,chloroacetic acid vinyl ester,vinyl chloroacetate polymer,vinyl monochloroacetate,chloroacetic acid vinyl,acetic acid, chloro-, vinyl ester, polymers,acmc-1clv7 PubChem CID: 82156 IUPAC Name: ethenyl 2-chloroacetate SMILES: C=COC(=O)CCl
| PubChem CID | 82156 |
|---|---|
| CAS | 2549-51-1 |
| Molecular Weight (g/mol) | 120.532 |
| MDL Number | MFCD00045275 |
| SMILES | C=COC(=O)CCl |
| Synonym | vinyl chloroacetate,acetic acid, chloro-, ethenyl ester,acetic acid, 2-chloro-, ethenyl ester,acetic acid, chloro-, vinyl ester,chloroacetic acid vinyl ester,vinyl chloroacetate polymer,vinyl monochloroacetate,chloroacetic acid vinyl,acetic acid, chloro-, vinyl ester, polymers,acmc-1clv7 |
| IUPAC Name | ethenyl 2-chloroacetate |
| InChI Key | XJELOQYISYPGDX-UHFFFAOYSA-N |
| Molecular Formula | C4H5ClO2 |
Ethyl m-Tolylacetate 98.0+%, TCI America™
CAS: 40061-55-0 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.231 MDL Number: MFCD00017273 InChI Key: RVIWPVAVHHVQIR-UHFFFAOYSA-N Synonym: ethyl m-tolylacetate,ethyl 2-3-methylphenyl acetate,ethyl meta-tolylacetate,ethyl 3-methylphenylacetate,m-tolylacetic acid ethyl ester,ethyl 2-m-tolyl acetate,benzeneacetic acid, 3-methyl-, ethyl ester,ethyl m-methylphenylacetate,3-methylphenylacetic acid ethyl ester,ethylm-tolylacetate PubChem CID: 96574 IUPAC Name: ethyl 2-(3-methylphenyl)acetate SMILES: CCOC(=O)CC1=CC=CC(=C1)C
| PubChem CID | 96574 |
|---|---|
| CAS | 40061-55-0 |
| Molecular Weight (g/mol) | 178.231 |
| MDL Number | MFCD00017273 |
| SMILES | CCOC(=O)CC1=CC=CC(=C1)C |
| Synonym | ethyl m-tolylacetate,ethyl 2-3-methylphenyl acetate,ethyl meta-tolylacetate,ethyl 3-methylphenylacetate,m-tolylacetic acid ethyl ester,ethyl 2-m-tolyl acetate,benzeneacetic acid, 3-methyl-, ethyl ester,ethyl m-methylphenylacetate,3-methylphenylacetic acid ethyl ester,ethylm-tolylacetate |
| IUPAC Name | ethyl 2-(3-methylphenyl)acetate |
| InChI Key | RVIWPVAVHHVQIR-UHFFFAOYSA-N |
| Molecular Formula | C11H14O2 |
Ethyl 1H-Tetrazole-5-acetate 98.0+%, TCI America™
CAS: 13616-37-0 Molecular Formula: C5H8N4O2 Molecular Weight (g/mol): 156.145 MDL Number: MFCD00274213 InChI Key: NAOHMNNTUFFTBF-UHFFFAOYSA-N Synonym: 1H-Tetrazole-5-acetic Acid Ethyl Ester PubChem CID: 543616 IUPAC Name: ethyl 2-(2H-tetrazol-5-yl)acetate SMILES: CCOC(=O)CC1=NNN=N1
| PubChem CID | 543616 |
|---|---|
| CAS | 13616-37-0 |
| Molecular Weight (g/mol) | 156.145 |
| MDL Number | MFCD00274213 |
| SMILES | CCOC(=O)CC1=NNN=N1 |
| Synonym | 1H-Tetrazole-5-acetic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-(2H-tetrazol-5-yl)acetate |
| InChI Key | NAOHMNNTUFFTBF-UHFFFAOYSA-N |
| Molecular Formula | C5H8N4O2 |
1-Dodecylhydantoin 98.0+%, TCI America™
CAS: 85391-28-2 Molecular Formula: C15H28N2O2 Molecular Weight (g/mol): 268.401 MDL Number: MFCD00142675 InChI Key: IHWNCNSXOZBQBX-UHFFFAOYSA-N Synonym: 1-Laurylhydantoin PubChem CID: 3020628 IUPAC Name: 1-dodecylimidazolidine-2,4-dione SMILES: CCCCCCCCCCCCN1CC(=O)NC1=O
| PubChem CID | 3020628 |
|---|---|
| CAS | 85391-28-2 |
| Molecular Weight (g/mol) | 268.401 |
| MDL Number | MFCD00142675 |
| SMILES | CCCCCCCCCCCCN1CC(=O)NC1=O |
| Synonym | 1-Laurylhydantoin |
| IUPAC Name | 1-dodecylimidazolidine-2,4-dione |
| InChI Key | IHWNCNSXOZBQBX-UHFFFAOYSA-N |
| Molecular Formula | C15H28N2O2 |
1,3-Diamino-2-propanol-N,N,N',N'-tetraacetic Acid 98.0+%, TCI America™
CAS: 3148-72-9 Molecular Formula: C11H18N2O9 Molecular Weight (g/mol): 322.27 MDL Number: MFCD00004288 InChI Key: WYMDDFRYORANCC-UHFFFAOYSA-N Synonym: dhpta,dpta,1,3-diaminopropanol tetraacetic acid,diaminohydroxypropane tetraacetic acid,1,3-diamino-2-propanol-n,n,n',n'-tetraacetic acid,diaminopropanol tetraacetic acid,unii-949b9zmo7m,1,3-diamino-2-hydroxypropane-n,n,n',n'-tetraacetic acid,2-hydroxy-1,3-propylenediaminetetraacetic acid,diaminopropanol tetra acetic acid PubChem CID: 18465 IUPAC Name: 2-[[3-[bis(carboxymethyl)amino]-2-hydroxypropyl]-(carboxymethyl)amino]acetic acid SMILES: C(C(CN(CC(=O)O)CC(=O)O)O)N(CC(=O)O)CC(=O)O
| PubChem CID | 18465 |
|---|---|
| CAS | 3148-72-9 |
| Molecular Weight (g/mol) | 322.27 |
| MDL Number | MFCD00004288 |
| SMILES | C(C(CN(CC(=O)O)CC(=O)O)O)N(CC(=O)O)CC(=O)O |
| Synonym | dhpta,dpta,1,3-diaminopropanol tetraacetic acid,diaminohydroxypropane tetraacetic acid,1,3-diamino-2-propanol-n,n,n',n'-tetraacetic acid,diaminopropanol tetraacetic acid,unii-949b9zmo7m,1,3-diamino-2-hydroxypropane-n,n,n',n'-tetraacetic acid,2-hydroxy-1,3-propylenediaminetetraacetic acid,diaminopropanol tetra acetic acid |
| IUPAC Name | 2-[[3-[bis(carboxymethyl)amino]-2-hydroxypropyl]-(carboxymethyl)amino]acetic acid |
| InChI Key | WYMDDFRYORANCC-UHFFFAOYSA-N |
| Molecular Formula | C11H18N2O9 |
N-Methylisatoic Anhydride 98.0+%, TCI America™
CAS: 10328-92-4 Molecular Formula: C9H7NO3 Molecular Weight (g/mol): 177.159 MDL Number: MFCD00006815 InChI Key: KJMRWDHBVCNLTQ-UHFFFAOYSA-N Synonym: n-methylisatoic anhydride,1-methyl-1h-benzo d 1,3 oxazine-2,4-dione,n-methyl ia,1-methyl-2h-3,1-benzoxazine-2,4 1h-dione,2h-3,1-benzoxazine-2,4 1h-dione, 1-methyl,n-methyl-n-carboxyanthranilic anhydride,methyl-n-carboxyanthranilic anhydride,1-methylbenzo d 1,3-oxazine-2,4-dione,n-methyl isotoic anhydride,1-methyl-2,4-dihydro-1h-3,1-benzoxazine-2,4-dione PubChem CID: 25160 ChEBI: CHEBI:59054 IUPAC Name: 1-methyl-3,1-benzoxazine-2,4-dione SMILES: CN1C2=CC=CC=C2C(=O)OC1=O
| PubChem CID | 25160 |
|---|---|
| CAS | 10328-92-4 |
| Molecular Weight (g/mol) | 177.159 |
| ChEBI | CHEBI:59054 |
| MDL Number | MFCD00006815 |
| SMILES | CN1C2=CC=CC=C2C(=O)OC1=O |
| Synonym | n-methylisatoic anhydride,1-methyl-1h-benzo d 1,3 oxazine-2,4-dione,n-methyl ia,1-methyl-2h-3,1-benzoxazine-2,4 1h-dione,2h-3,1-benzoxazine-2,4 1h-dione, 1-methyl,n-methyl-n-carboxyanthranilic anhydride,methyl-n-carboxyanthranilic anhydride,1-methylbenzo d 1,3-oxazine-2,4-dione,n-methyl isotoic anhydride,1-methyl-2,4-dihydro-1h-3,1-benzoxazine-2,4-dione |
| IUPAC Name | 1-methyl-3,1-benzoxazine-2,4-dione |
| InChI Key | KJMRWDHBVCNLTQ-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO3 |
4-Hydroxy-6-methyl-2-pyrone 98.0+%, TCI America™
CAS: 675-10-5 Molecular Formula: C6H6O3 Molecular Weight (g/mol): 126.11 MDL Number: MFCD00006641,MFCD18820248 InChI Key: OOKCZXGEYPSNIM-UHFFFAOYSA-N Synonym: 4-hydroxy-6-methyl-2-pyrone,2-hydroxy-6-methyl-4h-pyran-4-one,4-hydroxy-6-methyl-2h-pyran-2-one,triacetic acid lactone,triacetate lactone,2h-pyran-2-one, 4-hydroxy-6-methyl,6-methyl-4-hydroxypyron-2,unii-s1s883s4ee,6-methyl-4-hydroxy-2-pyrone,ccris 3600 PubChem CID: 54675757 ChEBI: CHEBI:16458 IUPAC Name: 2-hydroxy-6-methyl-4H-pyran-4-one SMILES: CC1=CC(=O)C=C(O)O1
| PubChem CID | 54675757 |
|---|---|
| CAS | 675-10-5 |
| Molecular Weight (g/mol) | 126.11 |
| ChEBI | CHEBI:16458 |
| MDL Number | MFCD00006641,MFCD18820248 |
| SMILES | CC1=CC(=O)C=C(O)O1 |
| Synonym | 4-hydroxy-6-methyl-2-pyrone,2-hydroxy-6-methyl-4h-pyran-4-one,4-hydroxy-6-methyl-2h-pyran-2-one,triacetic acid lactone,triacetate lactone,2h-pyran-2-one, 4-hydroxy-6-methyl,6-methyl-4-hydroxypyron-2,unii-s1s883s4ee,6-methyl-4-hydroxy-2-pyrone,ccris 3600 |
| IUPAC Name | 2-hydroxy-6-methyl-4H-pyran-4-one |
| InChI Key | OOKCZXGEYPSNIM-UHFFFAOYSA-N |
| Molecular Formula | C6H6O3 |
Hydroxychloroquine Sulfate 98.0+%, TCI America™
CAS: 747-36-4 Molecular Formula: C18H28ClN3O5S Molecular Weight (g/mol): 433.948 MDL Number: MFCD00078203 InChI Key: JCBIVZZPXRZKTI-UHFFFAOYSA-N Synonym: hydroxychloroquine sulfate,hydroxychloroquine sulphate,ercoquin,plaquinol,toremonil,2-4-7-chloroquinolin-4-yl amino pentyl ethyl amino ethanol sulfate,hydroxychloroquine sulfate usp,plaquenil tn,hydroxychloroquine; sulfuric acid,dsstox_cid_27788 PubChem CID: 12947 IUPAC Name: 2-[4-[(7-chloroquinolin-4-yl)amino]pentyl-ethylamino]ethanol;sulfuric acid SMILES: CCN(CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)CCO.OS(=O)(=O)O
| PubChem CID | 12947 |
|---|---|
| CAS | 747-36-4 |
| Molecular Weight (g/mol) | 433.948 |
| MDL Number | MFCD00078203 |
| SMILES | CCN(CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)CCO.OS(=O)(=O)O |
| Synonym | hydroxychloroquine sulfate,hydroxychloroquine sulphate,ercoquin,plaquinol,toremonil,2-4-7-chloroquinolin-4-yl amino pentyl ethyl amino ethanol sulfate,hydroxychloroquine sulfate usp,plaquenil tn,hydroxychloroquine; sulfuric acid,dsstox_cid_27788 |
| IUPAC Name | 2-[4-[(7-chloroquinolin-4-yl)amino]pentyl-ethylamino]ethanol;sulfuric acid |
| InChI Key | JCBIVZZPXRZKTI-UHFFFAOYSA-N |
| Molecular Formula | C18H28ClN3O5S |
4-Hexyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene 98.0+%, TCI America™
CAS: 883742-29-8 Molecular Formula: C16H27BO2S Molecular Weight (g/mol): 294.26 MDL Number: MFCD14708172 InChI Key: QEFQFMZHWUCJOA-UHFFFAOYSA-N Synonym: 2-(4-Hexyl-2-thienyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 4-Hexyl-2-thiopheneboronic Acid Pinacol Ester PubChem CID: 44630029 IUPAC Name: 2-(4-hexylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: CCCCCCC1=CSC(=C1)B1OC(C)(C)C(C)(C)O1
| PubChem CID | 44630029 |
|---|---|
| CAS | 883742-29-8 |
| Molecular Weight (g/mol) | 294.26 |
| MDL Number | MFCD14708172 |
| SMILES | CCCCCCC1=CSC(=C1)B1OC(C)(C)C(C)(C)O1 |
| Synonym | 2-(4-Hexyl-2-thienyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 4-Hexyl-2-thiopheneboronic Acid Pinacol Ester |
| IUPAC Name | 2-(4-hexylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI Key | QEFQFMZHWUCJOA-UHFFFAOYSA-N |
| Molecular Formula | C16H27BO2S |