Organic acids and derivatives
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Allyl Chloroacetate 98.0+%, TCI America™
CAS: 2916-14-5 Molecular Formula: C5H7ClO2 Molecular Weight (g/mol): 134.559 MDL Number: MFCD00058936 InChI Key: VMBJJCDVORDOCF-UHFFFAOYSA-N Synonym: allyl chloroacetate,allyl 2-chloroacetate,chloroacetic acid allyl ester,acetic acid, chloro-, 2-propenyl ester,prop-2-en-1-yl 2-chloroacetate,acetic acid, chloro-, allyl ester,allyl monochloroacetate,acmc-1cffa,chloroacetic acid,2-propenyl ester PubChem CID: 76206 IUPAC Name: prop-2-enyl 2-chloroacetate SMILES: C=CCOC(=O)CCl
| PubChem CID | 76206 |
|---|---|
| CAS | 2916-14-5 |
| Molecular Weight (g/mol) | 134.559 |
| MDL Number | MFCD00058936 |
| SMILES | C=CCOC(=O)CCl |
| Synonym | allyl chloroacetate,allyl 2-chloroacetate,chloroacetic acid allyl ester,acetic acid, chloro-, 2-propenyl ester,prop-2-en-1-yl 2-chloroacetate,acetic acid, chloro-, allyl ester,allyl monochloroacetate,acmc-1cffa,chloroacetic acid,2-propenyl ester |
| IUPAC Name | prop-2-enyl 2-chloroacetate |
| InChI Key | VMBJJCDVORDOCF-UHFFFAOYSA-N |
| Molecular Formula | C5H7ClO2 |
Ethyl Chloroacetate 98.0+%, TCI America™
CAS: 105-39-5 Molecular Formula: C4H7ClO2 Molecular Weight (g/mol): 122.548 MDL Number: MFCD00000932 InChI Key: VEUUMBGHMNQHGO-UHFFFAOYSA-N Synonym: ethyl chloroacetate,ethyl chloracetate,ethyl monochloroacetate,acetic acid, chloro-, ethyl ester,chloroacetic acid ethyl ester,ethyl monochloracetate,ethyl chloroethanoate,ethyl alpha-chloroacetate,2-chloroacetic acid ethyl ester,unii-6h07teh4tf PubChem CID: 7751 IUPAC Name: ethyl 2-chloroacetate SMILES: CCOC(=O)CCl
| PubChem CID | 7751 |
|---|---|
| CAS | 105-39-5 |
| Molecular Weight (g/mol) | 122.548 |
| MDL Number | MFCD00000932 |
| SMILES | CCOC(=O)CCl |
| Synonym | ethyl chloroacetate,ethyl chloracetate,ethyl monochloroacetate,acetic acid, chloro-, ethyl ester,chloroacetic acid ethyl ester,ethyl monochloracetate,ethyl chloroethanoate,ethyl alpha-chloroacetate,2-chloroacetic acid ethyl ester,unii-6h07teh4tf |
| IUPAC Name | ethyl 2-chloroacetate |
| InChI Key | VEUUMBGHMNQHGO-UHFFFAOYSA-N |
| Molecular Formula | C4H7ClO2 |
Isobutyl Crotonate 98.0+%, TCI America™
CAS: 589-66-2 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00036651 InChI Key: XDOWKOALJBOBBL-PLNGDYQASA-N Synonym: Crotonic Acid Isobutyl Ester, Isobutyl 2-Butenoate, 2-Butenoic Acid Isobuyl Ester PubChem CID: 6435824 IUPAC Name: 2-methylpropyl (2Z)-but-2-enoate SMILES: C\C=C/C(=O)OCC(C)C
| PubChem CID | 6435824 |
|---|---|
| CAS | 589-66-2 |
| Molecular Weight (g/mol) | 142.20 |
| MDL Number | MFCD00036651 |
| SMILES | C\C=C/C(=O)OCC(C)C |
| Synonym | Crotonic Acid Isobutyl Ester, Isobutyl 2-Butenoate, 2-Butenoic Acid Isobuyl Ester |
| IUPAC Name | 2-methylpropyl (2Z)-but-2-enoate |
| InChI Key | XDOWKOALJBOBBL-PLNGDYQASA-N |
| Molecular Formula | C8H14O2 |
Ethyl 3-Methylpyrazole-5-carboxylate 98.0+%, TCI America™
CAS: 4027-57-0 Molecular Formula: C7H10N2O2 Molecular Weight (g/mol): 154.17 MDL Number: MFCD00052514 InChI Key: BOTXQJAHRCGJEG-UHFFFAOYSA-N PubChem CID: 77645 IUPAC Name: ethyl 5-methyl-1H-pyrazole-3-carboxylate SMILES: CCOC(=O)C1=NNC(C)=C1
| PubChem CID | 77645 |
|---|---|
| CAS | 4027-57-0 |
| Molecular Weight (g/mol) | 154.17 |
| MDL Number | MFCD00052514 |
| SMILES | CCOC(=O)C1=NNC(C)=C1 |
| IUPAC Name | ethyl 5-methyl-1H-pyrazole-3-carboxylate |
| InChI Key | BOTXQJAHRCGJEG-UHFFFAOYSA-N |
| Molecular Formula | C7H10N2O2 |
1,2,3,4,6-Penta-O-acetyl-D-mannopyranose 97.0+%, TCI America™
CAS: 25941-03-1 Molecular Formula: C16H22O11 Molecular Weight (g/mol): 390.341 MDL Number: MFCD05864874 InChI Key: LPTITAGPBXDDGR-WHWZVRATSA-N Synonym: 1,2,3,4,6-penta-o-acetyl-d-mannopyranose,d-mannopyranose pentaacetate,3s,4s,5r,6r-6-acetoxymethyl tetrahydro-2h-pyran-2,3,4,5-tetrayl tetraacetate,2r,3r,4s,5s-3,4,5,6-tetrakis acetyloxy oxan-2-yl methyl acetate,mannopyranose pentaacetate,d-mannopyranose, pentaacetate,1,2,3,4,6-pentaacetate d-mannopyranose,d-mannopyranose,1,2,3,4,6-pentaacetate,1,2,3,4,6-penta-o-acetyl-dmannopyranose,1,2,3,4,6-penta-o-acetyl-alpha,beta-d-mannose PubChem CID: 11811209 IUPAC Name: [(2R,3R,4S,5S)-3,4,5,6-tetraacetyloxyoxan-2-yl]methyl acetate SMILES: CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
| PubChem CID | 11811209 |
|---|---|
| CAS | 25941-03-1 |
| Molecular Weight (g/mol) | 390.341 |
| MDL Number | MFCD05864874 |
| SMILES | CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C |
| Synonym | 1,2,3,4,6-penta-o-acetyl-d-mannopyranose,d-mannopyranose pentaacetate,3s,4s,5r,6r-6-acetoxymethyl tetrahydro-2h-pyran-2,3,4,5-tetrayl tetraacetate,2r,3r,4s,5s-3,4,5,6-tetrakis acetyloxy oxan-2-yl methyl acetate,mannopyranose pentaacetate,d-mannopyranose, pentaacetate,1,2,3,4,6-pentaacetate d-mannopyranose,d-mannopyranose,1,2,3,4,6-pentaacetate,1,2,3,4,6-penta-o-acetyl-dmannopyranose,1,2,3,4,6-penta-o-acetyl-alpha,beta-d-mannose |
| IUPAC Name | [(2R,3R,4S,5S)-3,4,5,6-tetraacetyloxyoxan-2-yl]methyl acetate |
| InChI Key | LPTITAGPBXDDGR-WHWZVRATSA-N |
| Molecular Formula | C16H22O11 |
Penta-O-acetyl-beta-D-glucopyranose 99.0+%, TCI America™
CAS: 604-69-3 Molecular Formula: C16H22O11 Molecular Weight (g/mol): 390.341 MDL Number: MFCD00006597 InChI Key: LPTITAGPBXDDGR-IBEHDNSVSA-N Synonym: beta-d-glucose pentaacetate,penta-o-acetyl-beta-d-glucopyranose,unii-v833p95coc,1,2,3,4,6-penta-o-acetyl-beta-d-glucopyranose,1,2,3,4,6-penta-o-acetyl-b-d-glucopyranose,beta-d-glucopyranose pentaacetate,2r,3r,4s,5r,6s-3,4,5,6-tetrakis acetyloxy oxan-2-yl methyl acetate,2s,3r,4s,5r,6r-6-acetoxymethyl tetrahydro-2h-pyran-2,3,4,5-tetrayl tetraacetate,glucopyranose, pentaacetate, .beta.-d,penta-o-acetyl-β PubChem CID: 2724702 IUPAC Name: [(2R,3R,4S,5R,6S)-3,4,5,6-tetraacetyloxyoxan-2-yl]methyl acetate SMILES: CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
| PubChem CID | 2724702 |
|---|---|
| CAS | 604-69-3 |
| Molecular Weight (g/mol) | 390.341 |
| MDL Number | MFCD00006597 |
| SMILES | CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C |
| Synonym | beta-d-glucose pentaacetate,penta-o-acetyl-beta-d-glucopyranose,unii-v833p95coc,1,2,3,4,6-penta-o-acetyl-beta-d-glucopyranose,1,2,3,4,6-penta-o-acetyl-b-d-glucopyranose,beta-d-glucopyranose pentaacetate,2r,3r,4s,5r,6s-3,4,5,6-tetrakis acetyloxy oxan-2-yl methyl acetate,2s,3r,4s,5r,6r-6-acetoxymethyl tetrahydro-2h-pyran-2,3,4,5-tetrayl tetraacetate,glucopyranose, pentaacetate, .beta.-d,penta-o-acetyl-β |
| IUPAC Name | [(2R,3R,4S,5R,6S)-3,4,5,6-tetraacetyloxyoxan-2-yl]methyl acetate |
| InChI Key | LPTITAGPBXDDGR-IBEHDNSVSA-N |
| Molecular Formula | C16H22O11 |
2-Cyanoethyl Acrylate (stabilized with MEHQ) 95.0+%, TCI America™
CAS: 106-71-8 Molecular Formula: C6H7NO2 Molecular Weight (g/mol): 125.13 MDL Number: MFCD00013823 InChI Key: AEPWOCLBLLCOGZ-UHFFFAOYSA-N Synonym: Acrylic Acid 2-Cyanoethyl Ester, 3-Acryloyloxypropionitrile PubChem CID: 7825 IUPAC Name: 2-cyanoethyl prop-2-enoate SMILES: C=CC(=O)OCCC#N
| PubChem CID | 7825 |
|---|---|
| CAS | 106-71-8 |
| Molecular Weight (g/mol) | 125.13 |
| MDL Number | MFCD00013823 |
| SMILES | C=CC(=O)OCCC#N |
| Synonym | Acrylic Acid 2-Cyanoethyl Ester, 3-Acryloyloxypropionitrile |
| IUPAC Name | 2-cyanoethyl prop-2-enoate |
| InChI Key | AEPWOCLBLLCOGZ-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO2 |
1,2,3,4,6-Penta-O-pivaloyl-D-mannopyranose 98.0+%, TCI America™
CAS: 220017-47-0 Molecular Formula: C31H52O11 Molecular Weight (g/mol): 600.746 InChI Key: PLXCBOJERHYNCS-AUGMSIGLSA-N PubChem CID: 11039291 IUPAC Name: [(2R,3R,4S,5S)-3,4,5,6-tetrakis(2,2-dimethylpropanoyloxy)oxan-2-yl]methyl 2,2-dimethylpropanoate SMILES: CC(C)(C)C(=O)OCC1C(C(C(C(O1)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C
| PubChem CID | 11039291 |
|---|---|
| CAS | 220017-47-0 |
| Molecular Weight (g/mol) | 600.746 |
| SMILES | CC(C)(C)C(=O)OCC1C(C(C(C(O1)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C |
| IUPAC Name | [(2R,3R,4S,5S)-3,4,5,6-tetrakis(2,2-dimethylpropanoyloxy)oxan-2-yl]methyl 2,2-dimethylpropanoate |
| InChI Key | PLXCBOJERHYNCS-AUGMSIGLSA-N |
| Molecular Formula | C31H52O11 |
3-(Carbamimidoylthio)-1-propanesulfonic Acid 98.0+%, TCI America™
CAS: 21668-81-5 Molecular Formula: C4H10N2O3S2 Molecular Weight (g/mol): 198.255 MDL Number: MFCD00085942 InChI Key: MQLJIOAPXLAGAP-UHFFFAOYSA-N Synonym: 3-amidinothio-1-propanesulfonic acid,3-s-isothiuronium propyl sulfonate,3-carbamimidoylthio propane-1-sulfonic acid,3-carbamimidoylsulfanyl propane-1-sulfonic acid,3-amino-iminomethyl-thio-1-propanesulfonic acid,3-carbamimidoylthio-1-propanesulfonic acid,3-aminoiminomethyl thio-1-propanesulfonic acid,3-aminoiminomethyl thio propanesulphonic acid,1-propanesulfonic acid,3-aminoiminomethyl thio PubChem CID: 89008 IUPAC Name: 3-carbamimidoylsulfanylpropane-1-sulfonic acid SMILES: C(CSC(=N)N)CS(=O)(=O)O
| PubChem CID | 89008 |
|---|---|
| CAS | 21668-81-5 |
| Molecular Weight (g/mol) | 198.255 |
| MDL Number | MFCD00085942 |
| SMILES | C(CSC(=N)N)CS(=O)(=O)O |
| Synonym | 3-amidinothio-1-propanesulfonic acid,3-s-isothiuronium propyl sulfonate,3-carbamimidoylthio propane-1-sulfonic acid,3-carbamimidoylsulfanyl propane-1-sulfonic acid,3-amino-iminomethyl-thio-1-propanesulfonic acid,3-carbamimidoylthio-1-propanesulfonic acid,3-aminoiminomethyl thio-1-propanesulfonic acid,3-aminoiminomethyl thio propanesulphonic acid,1-propanesulfonic acid,3-aminoiminomethyl thio |
| IUPAC Name | 3-carbamimidoylsulfanylpropane-1-sulfonic acid |
| InChI Key | MQLJIOAPXLAGAP-UHFFFAOYSA-N |
| Molecular Formula | C4H10N2O3S2 |
Benzyl Tiglate 97.0+%, TCI America™
CAS: 37526-88-8 Molecular Formula: C12H14O2 Molecular Weight (g/mol): 190.24 MDL Number: MFCD00017279 InChI Key: QRGSTISKDZCDHV-XCVCLJGOSA-N Synonym: benzyl tiglate,benzyl 2-methylcrotonate,benzyl trans-2,3-dimethylacrylate,e-benzyl 2-methylbut-2-enoate,benzyl trans-2-methyl-2-butenoate,unii-67uep899rr,benzyl 2-methyl-2-butenoate,benzyl trans-2-methylcrotonate,tiglic acid benzyl ester,benzyltiglate PubChem CID: 250096 IUPAC Name: benzyl (2E)-2-methylbut-2-enoate SMILES: C\C=C(/C)C(=O)OCC1=CC=CC=C1
| PubChem CID | 250096 |
|---|---|
| CAS | 37526-88-8 |
| Molecular Weight (g/mol) | 190.24 |
| MDL Number | MFCD00017279 |
| SMILES | C\C=C(/C)C(=O)OCC1=CC=CC=C1 |
| Synonym | benzyl tiglate,benzyl 2-methylcrotonate,benzyl trans-2,3-dimethylacrylate,e-benzyl 2-methylbut-2-enoate,benzyl trans-2-methyl-2-butenoate,unii-67uep899rr,benzyl 2-methyl-2-butenoate,benzyl trans-2-methylcrotonate,tiglic acid benzyl ester,benzyltiglate |
| IUPAC Name | benzyl (2E)-2-methylbut-2-enoate |
| InChI Key | QRGSTISKDZCDHV-XCVCLJGOSA-N |
| Molecular Formula | C12H14O2 |
Ethyl Chloroglyoxylate 98.0+%, TCI America™
CAS: 4755-77-5 Molecular Formula: C4H5ClO3 Molecular Weight (g/mol): 136.531 MDL Number: MFCD00000706 InChI Key: OWZFULPEVHKEKS-UHFFFAOYSA-N Synonym: ethyl chlorooxoacetate,ethyl oxalyl chloride,ethyl chloroglyoxylate,ethoxalyl chloride,ethyl oxalyl monochloride,acetic acid, chlorooxo-, ethyl ester,oxalic acid monoethyl ester chloride,monoethyl oxaloyl chloride,oxalyl chloride, ethyl ester,ethyl chlorocarbonyl formate PubChem CID: 20884 IUPAC Name: ethyl 2-chloro-2-oxoacetate SMILES: CCOC(=O)C(=O)Cl
| PubChem CID | 20884 |
|---|---|
| CAS | 4755-77-5 |
| Molecular Weight (g/mol) | 136.531 |
| MDL Number | MFCD00000706 |
| SMILES | CCOC(=O)C(=O)Cl |
| Synonym | ethyl chlorooxoacetate,ethyl oxalyl chloride,ethyl chloroglyoxylate,ethoxalyl chloride,ethyl oxalyl monochloride,acetic acid, chlorooxo-, ethyl ester,oxalic acid monoethyl ester chloride,monoethyl oxaloyl chloride,oxalyl chloride, ethyl ester,ethyl chlorocarbonyl formate |
| IUPAC Name | ethyl 2-chloro-2-oxoacetate |
| InChI Key | OWZFULPEVHKEKS-UHFFFAOYSA-N |
| Molecular Formula | C4H5ClO3 |
1,2,3,4,5,6-Cyclohexanehexacarboxylic Acid Monohydrate 97.0+%, TCI America™
CAS: 2216-84-4 Molecular Formula: C12H12O12 Molecular Weight (g/mol): 348.216 MDL Number: MFCD00081090 InChI Key: DTGRIEIJTWNZQF-UHFFFAOYSA-N PubChem CID: 102227 IUPAC Name: cyclohexane-1,2,3,4,5,6-hexacarboxylic acid SMILES: C1(C(C(C(C(C1C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O
| PubChem CID | 102227 |
|---|---|
| CAS | 2216-84-4 |
| Molecular Weight (g/mol) | 348.216 |
| MDL Number | MFCD00081090 |
| SMILES | C1(C(C(C(C(C1C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O |
| IUPAC Name | cyclohexane-1,2,3,4,5,6-hexacarboxylic acid |
| InChI Key | DTGRIEIJTWNZQF-UHFFFAOYSA-N |
| Molecular Formula | C12H12O12 |
Cyclohexylacetic Acid 98.0+%, TCI America™
CAS: 5292-21-7 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00001518 InChI Key: LJOODBDWMQKMFB-UHFFFAOYSA-N Synonym: cyclohexylacetic acid,cyclohexaneacetic acid,cyclohexylethanoic acid,hexahydrophenylacetic acid,cyclohexyl acetic acid,unii-v43k3to0hn,fema no. 2347,cyclohexane-acetic acid,v43k3to0hn,cyclo-hexylacetic acid PubChem CID: 21363 ChEBI: CHEBI:37277 IUPAC Name: 2-cyclohexylacetic acid SMILES: OC(=O)CC1CCCCC1
| PubChem CID | 21363 |
|---|---|
| CAS | 5292-21-7 |
| Molecular Weight (g/mol) | 142.20 |
| ChEBI | CHEBI:37277 |
| MDL Number | MFCD00001518 |
| SMILES | OC(=O)CC1CCCCC1 |
| Synonym | cyclohexylacetic acid,cyclohexaneacetic acid,cyclohexylethanoic acid,hexahydrophenylacetic acid,cyclohexyl acetic acid,unii-v43k3to0hn,fema no. 2347,cyclohexane-acetic acid,v43k3to0hn,cyclo-hexylacetic acid |
| IUPAC Name | 2-cyclohexylacetic acid |
| InChI Key | LJOODBDWMQKMFB-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
Succinamide 98.0+%, TCI America™
CAS: 110-14-5 Molecular Formula: C4H8N2O2 Molecular Weight (g/mol): 116.12 MDL Number: MFCD00008042 InChI Key: SNCZNSNPXMPCGN-UHFFFAOYSA-N Synonym: succinamide,succindiamide,succinic amide,succinic acid diamide,succinic diamide,succinic acid diimide,acmc-1bnit,ethane-1,2-dicarboxamide,aronis25142 PubChem CID: 8036 IUPAC Name: butanediamide SMILES: C(CC(=O)N)C(=O)N
| PubChem CID | 8036 |
|---|---|
| CAS | 110-14-5 |
| Molecular Weight (g/mol) | 116.12 |
| MDL Number | MFCD00008042 |
| SMILES | C(CC(=O)N)C(=O)N |
| Synonym | succinamide,succindiamide,succinic amide,succinic acid diamide,succinic diamide,succinic acid diimide,acmc-1bnit,ethane-1,2-dicarboxamide,aronis25142 |
| IUPAC Name | butanediamide |
| InChI Key | SNCZNSNPXMPCGN-UHFFFAOYSA-N |
| Molecular Formula | C4H8N2O2 |
Ethyl Stearate 96.0+%, TCI America™
CAS: 111-61-5 Molecular Formula: C20H40O2 Molecular Weight (g/mol): 312.538 MDL Number: MFCD00009006 InChI Key: MVLVMROFTAUDAG-UHFFFAOYSA-N Synonym: ethyl stearate,stearic acid ethyl ester,octadecanoic acid, ethyl ester,ethyl n-octadecanoate,stearic acid, ethyl ester,dicyclohexylammonium sulfate,unii-c64rtc734w,fema no. 3490,ethyl-stearate,ethyloctadecanoate PubChem CID: 8122 ChEBI: CHEBI:84936 IUPAC Name: ethyl octadecanoate SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC
| PubChem CID | 8122 |
|---|---|
| CAS | 111-61-5 |
| Molecular Weight (g/mol) | 312.538 |
| ChEBI | CHEBI:84936 |
| MDL Number | MFCD00009006 |
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC |
| Synonym | ethyl stearate,stearic acid ethyl ester,octadecanoic acid, ethyl ester,ethyl n-octadecanoate,stearic acid, ethyl ester,dicyclohexylammonium sulfate,unii-c64rtc734w,fema no. 3490,ethyl-stearate,ethyloctadecanoate |
| IUPAC Name | ethyl octadecanoate |
| InChI Key | MVLVMROFTAUDAG-UHFFFAOYSA-N |
| Molecular Formula | C20H40O2 |