Organic acids and derivatives
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Methyl DL-lactate, 99%
CAS: 547-64-8 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.105 MDL Number: MFCD00066367 InChI Key: LPEKGGXMPWTOCB-UHFFFAOYSA-N Synonym: methyl lactate,dl-methyl lactate,methyl dl-lactate,lactic acid methyl ester,methyl 2-hydroxypropionate,lactic acid, methyl ester,+--methyl lactate,propanoic acid, 2-hydroxy-, methyl ester,methyl alpha-hydroxypropionate,methyl-lactate PubChem CID: 11040 ChEBI: CHEBI:83221 IUPAC Name: methyl 2-hydroxypropanoate SMILES: CC(C(=O)OC)O
| PubChem CID | 11040 |
|---|---|
| CAS | 547-64-8 |
| Molecular Weight (g/mol) | 104.105 |
| ChEBI | CHEBI:83221 |
| MDL Number | MFCD00066367 |
| SMILES | CC(C(=O)OC)O |
| Synonym | methyl lactate,dl-methyl lactate,methyl dl-lactate,lactic acid methyl ester,methyl 2-hydroxypropionate,lactic acid, methyl ester,+--methyl lactate,propanoic acid, 2-hydroxy-, methyl ester,methyl alpha-hydroxypropionate,methyl-lactate |
| IUPAC Name | methyl 2-hydroxypropanoate |
| InChI Key | LPEKGGXMPWTOCB-UHFFFAOYSA-N |
| Molecular Formula | C4H8O3 |
Diethyl acetylmethylphosphonate, 97%, Thermo Scientific Chemicals
CAS: 1067-71-6 Molecular Formula: C7H15O4P Molecular Weight (g/mol): 194.167 MDL Number: MFCD00044728 InChI Key: RSAFKRSMGOSHRK-UHFFFAOYSA-N Synonym: diethyl 2-oxopropyl phosphonate,diethyl acetonylphosphonate,diethyl 2-oxopropylphosphonate,acetonylphosphonic acid diethyl ester,2-oxopropyl phosphonic acid diethyl ester,phosphonic acid, 2-oxopropyl-, diethyl ester,aurora ka-1476,ksc490a4t,diethyl acetylmethylphosphonate PubChem CID: 14028 IUPAC Name: 1-diethoxyphosphorylpropan-2-one SMILES: CCOP(=O)(CC(=O)C)OCC
| PubChem CID | 14028 |
|---|---|
| CAS | 1067-71-6 |
| Molecular Weight (g/mol) | 194.167 |
| MDL Number | MFCD00044728 |
| SMILES | CCOP(=O)(CC(=O)C)OCC |
| Synonym | diethyl 2-oxopropyl phosphonate,diethyl acetonylphosphonate,diethyl 2-oxopropylphosphonate,acetonylphosphonic acid diethyl ester,2-oxopropyl phosphonic acid diethyl ester,phosphonic acid, 2-oxopropyl-, diethyl ester,aurora ka-1476,ksc490a4t,diethyl acetylmethylphosphonate |
| IUPAC Name | 1-diethoxyphosphorylpropan-2-one |
| InChI Key | RSAFKRSMGOSHRK-UHFFFAOYSA-N |
| Molecular Formula | C7H15O4P |
2-Chloro-N-cyclopropylacetamide, 97%
CAS: 19047-31-5 Molecular Formula: C5H8ClNO Molecular Weight (g/mol): 133.58 MDL Number: MFCD00276391 InChI Key: ZPWIVSGEQGESFF-UHFFFAOYSA-N Synonym: n1-cyclopropyl-2-chloroacetamide,2-chloro-n-cyclopropyl-acetamide,n-cyclopropylchloroacetamide,acetamide,2-chloro-n-cyclopropyl PubChem CID: 735780 IUPAC Name: 2-chloro-N-cyclopropylacetamide SMILES: ClCC(=O)NC1CC1
| PubChem CID | 735780 |
|---|---|
| CAS | 19047-31-5 |
| Molecular Weight (g/mol) | 133.58 |
| MDL Number | MFCD00276391 |
| SMILES | ClCC(=O)NC1CC1 |
| Synonym | n1-cyclopropyl-2-chloroacetamide,2-chloro-n-cyclopropyl-acetamide,n-cyclopropylchloroacetamide,acetamide,2-chloro-n-cyclopropyl |
| IUPAC Name | 2-chloro-N-cyclopropylacetamide |
| InChI Key | ZPWIVSGEQGESFF-UHFFFAOYSA-N |
| Molecular Formula | C5H8ClNO |
Ethyl 2,2-difluoropropionate, 97%
CAS: 28781-85-3 Molecular Formula: C5H8F2O2 Molecular Weight (g/mol): 138.114 MDL Number: MFCD06657970 InChI Key: ISVLDAIKRGXNCZ-UHFFFAOYSA-N Synonym: 2,2-difluoropropionic acid ethyl ester,ethyl 2,2-difluoropropionate,2,2-difluoropropionicacidethylester,2,2-difluoro-propionic acid ethyl ester,propanoic acid, 2,2-difluoro-, ethyl ester,ethyl difluoropropionate,ethyl 2,2 difluoropropionate,difluoropropionic acid ethyl ester,2,2-difluoropropionic acidethyl ester PubChem CID: 2761188 IUPAC Name: ethyl 2,2-difluoropropanoate SMILES: CCOC(=O)C(C)(F)F
| PubChem CID | 2761188 |
|---|---|
| CAS | 28781-85-3 |
| Molecular Weight (g/mol) | 138.114 |
| MDL Number | MFCD06657970 |
| SMILES | CCOC(=O)C(C)(F)F |
| Synonym | 2,2-difluoropropionic acid ethyl ester,ethyl 2,2-difluoropropionate,2,2-difluoropropionicacidethylester,2,2-difluoro-propionic acid ethyl ester,propanoic acid, 2,2-difluoro-, ethyl ester,ethyl difluoropropionate,ethyl 2,2 difluoropropionate,difluoropropionic acid ethyl ester,2,2-difluoropropionic acidethyl ester |
| IUPAC Name | ethyl 2,2-difluoropropanoate |
| InChI Key | ISVLDAIKRGXNCZ-UHFFFAOYSA-N |
| Molecular Formula | C5H8F2O2 |
4-Aminobenzeneboronic acid hydrochloride, 97%
CAS: 80460-73-7 Molecular Formula: C6H9BClNO2 Molecular Weight (g/mol): 173.403 MDL Number: MFCD03001333 InChI Key: QBYGJJSFMOVYOA-UHFFFAOYSA-N Synonym: 4-aminophenylboronic acid hydrochloride,4-aminophenyl boronic acid hydrochloride,4-aminobenzeneboronic acid hydrochloride,4-aminophenylboronic acid hcl,4-boronoaniline hydrochloride,4-aminophenylboronic acid, hcl,boronic acid, 4-aminophenyl-, hydrochloride,pubchem1747,4-aminophenylboronicacidhydrochloride,ksc494e4p PubChem CID: 2734614 IUPAC Name: (4-aminophenyl)boronic acid;hydrochloride SMILES: B(C1=CC=C(C=C1)N)(O)O.Cl
| PubChem CID | 2734614 |
|---|---|
| CAS | 80460-73-7 |
| Molecular Weight (g/mol) | 173.403 |
| MDL Number | MFCD03001333 |
| SMILES | B(C1=CC=C(C=C1)N)(O)O.Cl |
| Synonym | 4-aminophenylboronic acid hydrochloride,4-aminophenyl boronic acid hydrochloride,4-aminobenzeneboronic acid hydrochloride,4-aminophenylboronic acid hcl,4-boronoaniline hydrochloride,4-aminophenylboronic acid, hcl,boronic acid, 4-aminophenyl-, hydrochloride,pubchem1747,4-aminophenylboronicacidhydrochloride,ksc494e4p |
| IUPAC Name | (4-aminophenyl)boronic acid;hydrochloride |
| InChI Key | QBYGJJSFMOVYOA-UHFFFAOYSA-N |
| Molecular Formula | C6H9BClNO2 |
Quinoxaline-6-carboxylic acid, 95%
CAS: 6925-00-4 Molecular Formula: C9H6N2O2 Molecular Weight (g/mol): 174.159 MDL Number: MFCD01365834 InChI Key: JGQDBVXRYDEWGM-UHFFFAOYSA-N Synonym: 6-quinoxalinecarboxylic acid,chinoxalin-6-carbonsaeure,quinoxaline-6-carboxylicacid,pubchem15419,quinoxaline-6-carboxylic acid PubChem CID: 674813 IUPAC Name: quinoxaline-6-carboxylic acid SMILES: C1=CC2=NC=CN=C2C=C1C(=O)O
| PubChem CID | 674813 |
|---|---|
| CAS | 6925-00-4 |
| Molecular Weight (g/mol) | 174.159 |
| MDL Number | MFCD01365834 |
| SMILES | C1=CC2=NC=CN=C2C=C1C(=O)O |
| Synonym | 6-quinoxalinecarboxylic acid,chinoxalin-6-carbonsaeure,quinoxaline-6-carboxylicacid,pubchem15419,quinoxaline-6-carboxylic acid |
| IUPAC Name | quinoxaline-6-carboxylic acid |
| InChI Key | JGQDBVXRYDEWGM-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2O2 |
12-Azidododecylphosphonic acid, 95%
CAS: 721457-32-5 Molecular Formula: C12H26N3O3P Molecular Weight (g/mol): 291.332 MDL Number: MFCD17012690 InChI Key: WHRLXOVKIALVOF-UHFFFAOYSA-N PubChem CID: 97638952 IUPAC Name: 12-azidododecylphosphonic acid SMILES: C(CCCCCCP(=O)(O)O)CCCCCN=[N+]=[N-]
| PubChem CID | 97638952 |
|---|---|
| CAS | 721457-32-5 |
| Molecular Weight (g/mol) | 291.332 |
| MDL Number | MFCD17012690 |
| SMILES | C(CCCCCCP(=O)(O)O)CCCCCN=[N+]=[N-] |
| IUPAC Name | 12-azidododecylphosphonic acid |
| InChI Key | WHRLXOVKIALVOF-UHFFFAOYSA-N |
| Molecular Formula | C12H26N3O3P |
12-Mercaptododecylphosphonic acid, 95%
CAS: 159239-33-5 Molecular Formula: C12H27O3PS Molecular Weight (g/mol): 282.38 MDL Number: MFCD11046116 InChI Key: PVIUMTORLYKRJT-UHFFFAOYSA-N Synonym: 12-mercaptododecylphosphonic acid,12-sulfanyldodecyl phosphonic acid PubChem CID: 45158994 IUPAC Name: 12-sulfanyldodecylphosphonic acid SMILES: OP(O)(=O)CCCCCCCCCCCCS
| PubChem CID | 45158994 |
|---|---|
| CAS | 159239-33-5 |
| Molecular Weight (g/mol) | 282.38 |
| MDL Number | MFCD11046116 |
| SMILES | OP(O)(=O)CCCCCCCCCCCCS |
| Synonym | 12-mercaptododecylphosphonic acid,12-sulfanyldodecyl phosphonic acid |
| IUPAC Name | 12-sulfanyldodecylphosphonic acid |
| InChI Key | PVIUMTORLYKRJT-UHFFFAOYSA-N |
| Molecular Formula | C12H27O3PS |
2,4-Dichlorobenzeneboronic acid, 98%
CAS: 68716-47-2 Molecular Formula: C6H5BCl2O2 Molecular Weight (g/mol): 190.81 MDL Number: MFCD00013930 InChI Key: QNEGDGPAXKYZHZ-UHFFFAOYSA-N Synonym: 2,4-dichlorophenyl boronic acid,2,4-dichlorobenzeneboronic acid,2,4-dichlorophenylbornic acid,2,4-dichlorophenyl boranediol,chembl20726,2,4-dichloro benzene boronic acid,boronic acid, 2,4-dichlorophenyl,2,4-dichlorobenzeneboron dihydroxide,2,4-dichlorobenzeneboronicacid PubChem CID: 2734659 IUPAC Name: (2,4-dichlorophenyl)boronic acid SMILES: OB(O)C1=CC=C(Cl)C=C1Cl
| PubChem CID | 2734659 |
|---|---|
| CAS | 68716-47-2 |
| Molecular Weight (g/mol) | 190.81 |
| MDL Number | MFCD00013930 |
| SMILES | OB(O)C1=CC=C(Cl)C=C1Cl |
| Synonym | 2,4-dichlorophenyl boronic acid,2,4-dichlorobenzeneboronic acid,2,4-dichlorophenylbornic acid,2,4-dichlorophenyl boranediol,chembl20726,2,4-dichloro benzene boronic acid,boronic acid, 2,4-dichlorophenyl,2,4-dichlorobenzeneboron dihydroxide,2,4-dichlorobenzeneboronicacid |
| IUPAC Name | (2,4-dichlorophenyl)boronic acid |
| InChI Key | QNEGDGPAXKYZHZ-UHFFFAOYSA-N |
| Molecular Formula | C6H5BCl2O2 |
Pyridinium trifluoromethanesulfonate, 97%
CAS: 52193-54-1 MDL Number: MFCD00274656 Synonym: pyridinium trifluoromethanesulfonate,pyridinium triflate,pyridin-1-ium trifluoromethanesulfonate,pyridium triflate,acmc-209ky5,pyridinium trifluoromethanesulphonate,pyridin-1-ium; trifluoromethanesulfonate
| CAS | 52193-54-1 |
|---|---|
| MDL Number | MFCD00274656 |
| Synonym | pyridinium trifluoromethanesulfonate,pyridinium triflate,pyridin-1-ium trifluoromethanesulfonate,pyridium triflate,acmc-209ky5,pyridinium trifluoromethanesulphonate,pyridin-1-ium; trifluoromethanesulfonate |
3-(2-Pyridyl)propionic acid, 97%
CAS: 15197-75-8 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00995159 InChI Key: AZYKGQOIAGPVCK-UHFFFAOYSA-N Synonym: 3-pyridin-2-yl propanoic acid,3-2-pyridyl propionic acid,3-pyridin-2-yl-propionic acid,2-pyridinepropanoic acid,3-2-pyridinyl propanoic acid,pyridine-2-propionic acid,2-3-pyridyl propionic acid,3-2-pyridyl propanoic acid,3-2-pyridyl-propionic acid,2-pyridinepropanoicacid PubChem CID: 564292 IUPAC Name: 3-pyridin-2-ylpropanoic acid SMILES: C1=CC=NC(=C1)CCC(=O)O
| PubChem CID | 564292 |
|---|---|
| CAS | 15197-75-8 |
| Molecular Weight (g/mol) | 151.165 |
| MDL Number | MFCD00995159 |
| SMILES | C1=CC=NC(=C1)CCC(=O)O |
| Synonym | 3-pyridin-2-yl propanoic acid,3-2-pyridyl propionic acid,3-pyridin-2-yl-propionic acid,2-pyridinepropanoic acid,3-2-pyridinyl propanoic acid,pyridine-2-propionic acid,2-3-pyridyl propionic acid,3-2-pyridyl propanoic acid,3-2-pyridyl-propionic acid,2-pyridinepropanoicacid |
| IUPAC Name | 3-pyridin-2-ylpropanoic acid |
| InChI Key | AZYKGQOIAGPVCK-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO2 |
2-(Trifluoromethyl)pyridine-5-boronic acid, 98%
CAS: 868662-36-6 Molecular Formula: C6H5BF3NO2 Molecular Weight (g/mol): 190.916 MDL Number: MFCD07375381 InChI Key: BNTIPMNMTIAWIW-UHFFFAOYSA-N Synonym: 2-trifluoromethyl pyridine-5-boronic acid,6-trifluoromethyl pyridin-3-yl boronic acid,2-trifluoromethyl-5-pyridineboric acid,2-trifluoromethyl pyridin-5-ylboronic acid,6-trifluoromethyl pyridine-3-boronic acid,6-trifluoromethyl pyridin-3-ylboronic acid,2-trifluoromethylpyridine-5-boronic acid,2-trifluoromethyl-5-pyridineboronic acid,6-trifluoromethyl-3-pyridylboronic acid PubChem CID: 25134278 IUPAC Name: [6-(trifluoromethyl)pyridin-3-yl]boronic acid SMILES: B(C1=CN=C(C=C1)C(F)(F)F)(O)O
| PubChem CID | 25134278 |
|---|---|
| CAS | 868662-36-6 |
| Molecular Weight (g/mol) | 190.916 |
| MDL Number | MFCD07375381 |
| SMILES | B(C1=CN=C(C=C1)C(F)(F)F)(O)O |
| Synonym | 2-trifluoromethyl pyridine-5-boronic acid,6-trifluoromethyl pyridin-3-yl boronic acid,2-trifluoromethyl-5-pyridineboric acid,2-trifluoromethyl pyridin-5-ylboronic acid,6-trifluoromethyl pyridine-3-boronic acid,6-trifluoromethyl pyridin-3-ylboronic acid,2-trifluoromethylpyridine-5-boronic acid,2-trifluoromethyl-5-pyridineboronic acid,6-trifluoromethyl-3-pyridylboronic acid |
| IUPAC Name | [6-(trifluoromethyl)pyridin-3-yl]boronic acid |
| InChI Key | BNTIPMNMTIAWIW-UHFFFAOYSA-N |
| Molecular Formula | C6H5BF3NO2 |
beta-D-Ribofuranose 1,2,3,5-tetraacetate, 98+%
CAS: 13035-61-5 Molecular Formula: C13H18O9 Molecular Weight (g/mol): 318.278 MDL Number: MFCD00005358 InChI Key: IHNHAHWGVLXCCI-FDYHWXHSSA-N Synonym: beta-d-ribofuranose 1,2,3,5-tetraacetate,tetra-o-acetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-beta-d-ribofuranose,tetraacetylribose,1,2,3,5-tetraacetyl-.-d-ribofuranose,tetra-o-acetyl-b-d-ribofuranose,1,2,3,5-tetraacetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-b-d-ribofuranose,.beta.-d-ribofuranose, tetraacetate,ribofuranose, tetraacetate, .beta.-d PubChem CID: 83064 IUPAC Name: [(2R,3R,4R,5S)-3,4,5-triacetyloxyoxolan-2-yl]methyl acetate SMILES: CC(=O)OCC1C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C
| PubChem CID | 83064 |
|---|---|
| CAS | 13035-61-5 |
| Molecular Weight (g/mol) | 318.278 |
| MDL Number | MFCD00005358 |
| SMILES | CC(=O)OCC1C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C |
| Synonym | beta-d-ribofuranose 1,2,3,5-tetraacetate,tetra-o-acetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-beta-d-ribofuranose,tetraacetylribose,1,2,3,5-tetraacetyl-.-d-ribofuranose,tetra-o-acetyl-b-d-ribofuranose,1,2,3,5-tetraacetyl-beta-d-ribofuranose,1,2,3,5-tetra-o-acetyl-b-d-ribofuranose,.beta.-d-ribofuranose, tetraacetate,ribofuranose, tetraacetate, .beta.-d |
| IUPAC Name | [(2R,3R,4R,5S)-3,4,5-triacetyloxyoxolan-2-yl]methyl acetate |
| InChI Key | IHNHAHWGVLXCCI-FDYHWXHSSA-N |
| Molecular Formula | C13H18O9 |
Ethyl cyclohexylideneacetate, 98%
CAS: 1552-92-7 Molecular Formula: C10H16O2 Molecular Weight (g/mol): 168.24 MDL Number: MFCD00017627,MFCD00963857 InChI Key: MCWDXHYYYNGYGK-UHFFFAOYSA-N Synonym: ethyl cyclohexylideneacetate,acetic acid, cyclohexylidene-, ethyl ester,ethyl 2-cyclohexylidenacetate,cyclohexylideneacetic acid ethyl ester,ethoxycarbonylmethylenecyclohexane,.delta.1,.alpha.-cyclohexaneacetic acid, ethyl ester,acmc-20ahxr,ethylcyclohexylidenacetate,.delta.1, ethyl ester,ethyl2-cyclohexylideneacetate PubChem CID: 73776 IUPAC Name: ethyl 2-cyclohexylideneacetate SMILES: CCOC(=O)C=C1CCCCC1
| PubChem CID | 73776 |
|---|---|
| CAS | 1552-92-7 |
| Molecular Weight (g/mol) | 168.24 |
| MDL Number | MFCD00017627,MFCD00963857 |
| SMILES | CCOC(=O)C=C1CCCCC1 |
| Synonym | ethyl cyclohexylideneacetate,acetic acid, cyclohexylidene-, ethyl ester,ethyl 2-cyclohexylidenacetate,cyclohexylideneacetic acid ethyl ester,ethoxycarbonylmethylenecyclohexane,.delta.1,.alpha.-cyclohexaneacetic acid, ethyl ester,acmc-20ahxr,ethylcyclohexylidenacetate,.delta.1, ethyl ester,ethyl2-cyclohexylideneacetate |
| IUPAC Name | ethyl 2-cyclohexylideneacetate |
| InChI Key | MCWDXHYYYNGYGK-UHFFFAOYSA-N |
| Molecular Formula | C10H16O2 |
Ethyl 4-cyanophenylacetate, 98%, Thermo Scientific Chemicals
CAS: 1528-41-2 Molecular Formula: C11H11NO2 Molecular Weight (g/mol): 189.214 MDL Number: MFCD09953133 InChI Key: DFEWKWBIPMKGFG-UHFFFAOYSA-N Synonym: ethyl 2-4-cyanophenyl acetate,ethyl 4-cyanophenylacetate,ethyl 4-cyanophenyl acetate,4-cyano-phenyl acetic acid ethyl ester,ethyl p-cyanophenylacetate,acmc-1bve3,ethyl 4-cyanobenzeneacetate,ethyl4-cyanophenylacetate,4-cyanophenylacetic acid ethyl ester PubChem CID: 279718 IUPAC Name: ethyl 2-(4-cyanophenyl)acetate SMILES: CCOC(=O)CC1=CC=C(C=C1)C#N
| PubChem CID | 279718 |
|---|---|
| CAS | 1528-41-2 |
| Molecular Weight (g/mol) | 189.214 |
| MDL Number | MFCD09953133 |
| SMILES | CCOC(=O)CC1=CC=C(C=C1)C#N |
| Synonym | ethyl 2-4-cyanophenyl acetate,ethyl 4-cyanophenylacetate,ethyl 4-cyanophenyl acetate,4-cyano-phenyl acetic acid ethyl ester,ethyl p-cyanophenylacetate,acmc-1bve3,ethyl 4-cyanobenzeneacetate,ethyl4-cyanophenylacetate,4-cyanophenylacetic acid ethyl ester |
| IUPAC Name | ethyl 2-(4-cyanophenyl)acetate |
| InChI Key | DFEWKWBIPMKGFG-UHFFFAOYSA-N |
| Molecular Formula | C11H11NO2 |