Organic acids and derivatives
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Allyl methyl carbonate, 98%
CAS: 35466-83-2 Molecular Formula: C5H8O3 Molecular Weight (g/mol): 116.12 MDL Number: MFCD00134545 InChI Key: YHLVIDQQTOMBGN-UHFFFAOYSA-N Synonym: allyl methyl carbonate,methyl prop-2-en-1-yl carbonate,carbonic acid allyl methyl ester,isobutylene carbonate,methyl allyl carbonate,acmc-1agon,allyl methyl carbonate #,prop-2-enyl methoxyformate,yhlvidqqtombgn-uhfffaoysa PubChem CID: 534788 IUPAC Name: methyl prop-2-enyl carbonate SMILES: COC(=O)OCC=C
| PubChem CID | 534788 |
|---|---|
| CAS | 35466-83-2 |
| Molecular Weight (g/mol) | 116.12 |
| MDL Number | MFCD00134545 |
| SMILES | COC(=O)OCC=C |
| Synonym | allyl methyl carbonate,methyl prop-2-en-1-yl carbonate,carbonic acid allyl methyl ester,isobutylene carbonate,methyl allyl carbonate,acmc-1agon,allyl methyl carbonate #,prop-2-enyl methoxyformate,yhlvidqqtombgn-uhfffaoysa |
| IUPAC Name | methyl prop-2-enyl carbonate |
| InChI Key | YHLVIDQQTOMBGN-UHFFFAOYSA-N |
| Molecular Formula | C5H8O3 |
2,2-Dichloroacetamide, 98+%
CAS: 683-72-7 Molecular Formula: C2H3Cl2NO Molecular Weight (g/mol): 127.952 MDL Number: MFCD00008015 InChI Key: WCGGWVOVFQNRRS-UHFFFAOYSA-N PubChem CID: 12694 IUPAC Name: 2,2-dichloroacetamide SMILES: C(C(=O)N)(Cl)Cl
| PubChem CID | 12694 |
|---|---|
| CAS | 683-72-7 |
| Molecular Weight (g/mol) | 127.952 |
| MDL Number | MFCD00008015 |
| SMILES | C(C(=O)N)(Cl)Cl |
| IUPAC Name | 2,2-dichloroacetamide |
| InChI Key | WCGGWVOVFQNRRS-UHFFFAOYSA-N |
| Molecular Formula | C2H3Cl2NO |
4-Fluoro-3-(tetrazol-5-yl)phenylboronic acid, 95%, Thermo Scientific™
CAS: 1009303-56-3 Molecular Formula: C7H6BFN4O2 Molecular Weight (g/mol): 207.96 MDL Number: MFCD13176533 InChI Key: FELFJHZMQYCKPT-UHFFFAOYSA-N Synonym: 4-fluoro-3-tetrazol-5-yl phenylboronic acid,4-fluoro-3-1h-1,2,3,4-tetrazol-5-yl phenylboronic acid,4-fluoro-3-1h-tetrazol-5-yl phenyl boronic acid,4-fluoro-3-1h-tetrazol-5-yl phenylboronic acid PubChem CID: 11287236 IUPAC Name: [4-fluoro-3-(2H-tetrazol-5-yl)phenyl]boronic acid SMILES: OB(O)C1=CC(C2=NNN=N2)=C(F)C=C1
| PubChem CID | 11287236 |
|---|---|
| CAS | 1009303-56-3 |
| Molecular Weight (g/mol) | 207.96 |
| MDL Number | MFCD13176533 |
| SMILES | OB(O)C1=CC(C2=NNN=N2)=C(F)C=C1 |
| Synonym | 4-fluoro-3-tetrazol-5-yl phenylboronic acid,4-fluoro-3-1h-1,2,3,4-tetrazol-5-yl phenylboronic acid,4-fluoro-3-1h-tetrazol-5-yl phenyl boronic acid,4-fluoro-3-1h-tetrazol-5-yl phenylboronic acid |
| IUPAC Name | [4-fluoro-3-(2H-tetrazol-5-yl)phenyl]boronic acid |
| InChI Key | FELFJHZMQYCKPT-UHFFFAOYSA-N |
| Molecular Formula | C7H6BFN4O2 |
1-Pentanesulfonic Acid Sodium Salt, Monohydrate, HPLC Grade, 98%, Spectrum™ Chemical
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CAS: 207605-40-1 Molecular Formula: C5H11O3S Molecular Weight (g/mol): 151.20 InChI Key: RJQRCOMHVBLQIH-UHFFFAOYSA-M IUPAC Name: pentane-1-sulfonate SMILES: CCCCCS([O-])(=O)=O
| CAS | 207605-40-1 |
|---|---|
| Molecular Weight (g/mol) | 151.20 |
| SMILES | CCCCCS([O-])(=O)=O |
| IUPAC Name | pentane-1-sulfonate |
| InChI Key | RJQRCOMHVBLQIH-UHFFFAOYSA-M |
| Molecular Formula | C5H11O3S |
1-Naphthaleneacetic Acid, 97%, Spectrum™ Chemical
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CAS: 86-87-3 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00004046 InChI Key: PRPINYUDVPFIRX-UHFFFAOYSA-N IUPAC Name: 2-(naphthalen-1-yl)acetic acid SMILES: OC(=O)CC1=C2C=CC=CC2=CC=C1
| CAS | 86-87-3 |
|---|---|
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD00004046 |
| SMILES | OC(=O)CC1=C2C=CC=CC2=CC=C1 |
| IUPAC Name | 2-(naphthalen-1-yl)acetic acid |
| InChI Key | PRPINYUDVPFIRX-UHFFFAOYSA-N |
| Molecular Formula | C12H10O2 |
Sodium Propionate, NF, 99-100.5%, Spectrum™ Chemical
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CAS: 6700-17-0 Molecular Formula: C3H7NaO3 Molecular Weight (g/mol): 114.08 InChI Key: HOAUAOBUGFYWMK-UHFFFAOYSA-M IUPAC Name: sodium hydrate propanoate SMILES: O.[Na+].CCC([O-])=O
| CAS | 6700-17-0 |
|---|---|
| Molecular Weight (g/mol) | 114.08 |
| SMILES | O.[Na+].CCC([O-])=O |
| IUPAC Name | sodium hydrate propanoate |
| InChI Key | HOAUAOBUGFYWMK-UHFFFAOYSA-M |
| Molecular Formula | C3H7NaO3 |
DL-Tropic acid, 97%
CAS: 552-63-6 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00004255 InChI Key: JACRWUWPXAESPB-UHFFFAOYNA-N Synonym: tropic acid,dl-tropic acid,2-phenylhydracrylic acid,3-hydroxy-2-phenylpropionic acid,+--tropic acid,tropate,alpha-hydroxymethyl benzeneacetic acid,beta-hydroxyhydratropic acid,hydracrylic acid, 2-phenyl,alpha-hydroxymethyl phenylacetic acid PubChem CID: 10726 ChEBI: CHEBI:30765 IUPAC Name: 3-hydroxy-2-phenylpropanoic acid SMILES: OCC(C(O)=O)C1=CC=CC=C1
| PubChem CID | 10726 |
|---|---|
| CAS | 552-63-6 |
| Molecular Weight (g/mol) | 166.18 |
| ChEBI | CHEBI:30765 |
| MDL Number | MFCD00004255 |
| SMILES | OCC(C(O)=O)C1=CC=CC=C1 |
| Synonym | tropic acid,dl-tropic acid,2-phenylhydracrylic acid,3-hydroxy-2-phenylpropionic acid,+--tropic acid,tropate,alpha-hydroxymethyl benzeneacetic acid,beta-hydroxyhydratropic acid,hydracrylic acid, 2-phenyl,alpha-hydroxymethyl phenylacetic acid |
| IUPAC Name | 3-hydroxy-2-phenylpropanoic acid |
| InChI Key | JACRWUWPXAESPB-UHFFFAOYNA-N |
| Molecular Formula | C9H10O3 |
Methyl Benzoate, 98%, Spectrum™ Chemical
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CAS: 93-58-3
| CAS | 93-58-3 |
|---|
Ethyl oleate, tech. 70%
CAS: 111-62-6 Molecular Formula: C20H38O2 Molecular Weight (g/mol): 310.522 MDL Number: MFCD00009579 InChI Key: LVGKNOAMLMIIKO-QXMHVHEDSA-N Synonym: ethyl oleate,ethyl cis-9-octadecenoate,oleic acid, ethyl ester,oleic acid ethyl ester,9-octadecenoic acid z-, ethyl ester,ethyl oleate nf,ethyl z-octadec-9-enoate,ethyl oleate natural,fema no. 2450 PubChem CID: 5363269 ChEBI: CHEBI:84940 IUPAC Name: ethyl (Z)-octadec-9-enoate SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC
| PubChem CID | 5363269 |
|---|---|
| CAS | 111-62-6 |
| Molecular Weight (g/mol) | 310.522 |
| ChEBI | CHEBI:84940 |
| MDL Number | MFCD00009579 |
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCC |
| Synonym | ethyl oleate,ethyl cis-9-octadecenoate,oleic acid, ethyl ester,oleic acid ethyl ester,9-octadecenoic acid z-, ethyl ester,ethyl oleate nf,ethyl z-octadec-9-enoate,ethyl oleate natural,fema no. 2450 |
| IUPAC Name | ethyl (Z)-octadec-9-enoate |
| InChI Key | LVGKNOAMLMIIKO-QXMHVHEDSA-N |
| Molecular Formula | C20H38O2 |
Ethyl 2-amino-4-methylthiophene-3-carboxylate, 98+%
CAS: 43088-42-2 Molecular Formula: C8H11NO2S Molecular Weight (g/mol): 185.241 MDL Number: MFCD00051669 InChI Key: ILYCZKOBLRJJSW-UHFFFAOYSA-N Synonym: 2-amino-4-methylthiophene-3-carboxylic acid ethyl ester,2-amino-4-methyl-thiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylic acid, 2-amino-4-methyl-, ethyl ester,ethyl2-amino-4-methylthiophene-3-carboxylate,ethyl 2-amino-4-methyl-3-thiophenecarboxylate,acmc-20a9ux,maybridge1_003755,2-amino-4-methyl-3-ethoxycarbonyl-thiophene,ethyl 2-amino4-methylthiophene-3-carboxylate,2-amino-3-ethoxycarbonyl-4-methylthiophene PubChem CID: 521132 IUPAC Name: ethyl 2-amino-4-methylthiophene-3-carboxylate SMILES: CCOC(=O)C1=C(SC=C1C)N
| PubChem CID | 521132 |
|---|---|
| CAS | 43088-42-2 |
| Molecular Weight (g/mol) | 185.241 |
| MDL Number | MFCD00051669 |
| SMILES | CCOC(=O)C1=C(SC=C1C)N |
| Synonym | 2-amino-4-methylthiophene-3-carboxylic acid ethyl ester,2-amino-4-methyl-thiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylic acid, 2-amino-4-methyl-, ethyl ester,ethyl2-amino-4-methylthiophene-3-carboxylate,ethyl 2-amino-4-methyl-3-thiophenecarboxylate,acmc-20a9ux,maybridge1_003755,2-amino-4-methyl-3-ethoxycarbonyl-thiophene,ethyl 2-amino4-methylthiophene-3-carboxylate,2-amino-3-ethoxycarbonyl-4-methylthiophene |
| IUPAC Name | ethyl 2-amino-4-methylthiophene-3-carboxylate |
| InChI Key | ILYCZKOBLRJJSW-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO2S |
Thermo Scientific Chemicals Cytidine 5'-monophosphate hydrate, 99%
CAS: 63-37-6 Molecular Formula: C9H14N3O8P Molecular Weight (g/mol): 323.20 MDL Number: MFCD00006544 InChI Key: IERHLVCPSMICTF-NHBCCFCANA-N Synonym: 5'-cytidylic acid,cytidylic acid,cytidine 5'-monophosphate,cytidine monophosphate,cytidine-5'-monophosphate,5'-cmp,cytidylate,cytidine 5'-phosphate,cmp nucleotide,cytidine 5'-phosphoric acid PubChem CID: 6131 ChEBI: CHEBI:17361 IUPAC Name: [(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate SMILES: NC1=NC(=O)N(C=C1)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O
| PubChem CID | 6131 |
|---|---|
| CAS | 63-37-6 |
| Molecular Weight (g/mol) | 323.20 |
| ChEBI | CHEBI:17361 |
| MDL Number | MFCD00006544 |
| SMILES | NC1=NC(=O)N(C=C1)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O |
| Synonym | 5'-cytidylic acid,cytidylic acid,cytidine 5'-monophosphate,cytidine monophosphate,cytidine-5'-monophosphate,5'-cmp,cytidylate,cytidine 5'-phosphate,cmp nucleotide,cytidine 5'-phosphoric acid |
| IUPAC Name | [(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate |
| InChI Key | IERHLVCPSMICTF-NHBCCFCANA-N |
| Molecular Formula | C9H14N3O8P |
1-Methyl-3-phenyl-1H-pyrazole-5-carboxylic acid, 97%, Thermo Scientific™
CAS: 10250-64-3 Molecular Formula: C11H10N2O2 Molecular Weight (g/mol): 202.213 MDL Number: MFCD08271939 InChI Key: RTBQZMPYPFQBHA-UHFFFAOYSA-N PubChem CID: 7537625 IUPAC Name: 2-methyl-5-phenylpyrazole-3-carboxylic acid SMILES: CN1C(=CC(=N1)C2=CC=CC=C2)C(=O)O
| PubChem CID | 7537625 |
|---|---|
| CAS | 10250-64-3 |
| Molecular Weight (g/mol) | 202.213 |
| MDL Number | MFCD08271939 |
| SMILES | CN1C(=CC(=N1)C2=CC=CC=C2)C(=O)O |
| IUPAC Name | 2-methyl-5-phenylpyrazole-3-carboxylic acid |
| InChI Key | RTBQZMPYPFQBHA-UHFFFAOYSA-N |
| Molecular Formula | C11H10N2O2 |
Pyridazine-3-carboxylic acid, 97%
CAS: 2164-61-6 Molecular Formula: C5H4N2O2 Molecular Weight (g/mol): 124.099 MDL Number: MFCD01646333 InChI Key: RUUOPSRRIKJHNH-UHFFFAOYSA-N Synonym: 3-pyridazinecarboxylic acid,3-carboxypyridazine,3-pyridazine carboxylic acid,pubchem22109,pyridazine carboxylic acid,ksc202q0p,pyridazine-3-carboxylic acid,3-carboxypyridazine; 3-pyridazinecarboxylic acid; PubChem CID: 269369 IUPAC Name: pyridazine-3-carboxylic acid SMILES: C1=CC(=NN=C1)C(=O)O
| PubChem CID | 269369 |
|---|---|
| CAS | 2164-61-6 |
| Molecular Weight (g/mol) | 124.099 |
| MDL Number | MFCD01646333 |
| SMILES | C1=CC(=NN=C1)C(=O)O |
| Synonym | 3-pyridazinecarboxylic acid,3-carboxypyridazine,3-pyridazine carboxylic acid,pubchem22109,pyridazine carboxylic acid,ksc202q0p,pyridazine-3-carboxylic acid,3-carboxypyridazine; 3-pyridazinecarboxylic acid; |
| IUPAC Name | pyridazine-3-carboxylic acid |
| InChI Key | RUUOPSRRIKJHNH-UHFFFAOYSA-N |
| Molecular Formula | C5H4N2O2 |
2,2,3,3,3-Pentafluoropropyl acrylate, 97%
CAS: 356-86-5 Molecular Formula: C6H5F5O2 Molecular Weight (g/mol): 204.10 MDL Number: MFCD00039257 InChI Key: JDVGNKIUXZQTFD-UHFFFAOYSA-N Synonym: 2,2,3,3,3-pentafluoropropyl acrylate,1h,1h-pentafluoropropyl acrylate,2-propenoic acid, 2,2,3,3,3-pentafluoropropyl ester,acmc-20aokp,acrylic acid=2,2,3,3,3-pentafluoropropyl ester,acrylic acid 2,2,3,3,3-pentafluoropropyl ester,2-propenoic acid,2,2,3,3,3-pentafluoropropyl ester,2,2,3,3,3-pentafluoropropyl acrylate stabilized with tbc,2,2,3,3,3-pentafluoropropyl acrylate, contains 100 ppm 4-tert-butylcatechol as inhibitor PubChem CID: 67744 IUPAC Name: 2,2,3,3,3-pentafluoropropyl prop-2-enoate SMILES: FC(F)(F)C(F)(F)COC(=O)C=C
| PubChem CID | 67744 |
|---|---|
| CAS | 356-86-5 |
| Molecular Weight (g/mol) | 204.10 |
| MDL Number | MFCD00039257 |
| SMILES | FC(F)(F)C(F)(F)COC(=O)C=C |
| Synonym | 2,2,3,3,3-pentafluoropropyl acrylate,1h,1h-pentafluoropropyl acrylate,2-propenoic acid, 2,2,3,3,3-pentafluoropropyl ester,acmc-20aokp,acrylic acid=2,2,3,3,3-pentafluoropropyl ester,acrylic acid 2,2,3,3,3-pentafluoropropyl ester,2-propenoic acid,2,2,3,3,3-pentafluoropropyl ester,2,2,3,3,3-pentafluoropropyl acrylate stabilized with tbc,2,2,3,3,3-pentafluoropropyl acrylate, contains 100 ppm 4-tert-butylcatechol as inhibitor |
| IUPAC Name | 2,2,3,3,3-pentafluoropropyl prop-2-enoate |
| InChI Key | JDVGNKIUXZQTFD-UHFFFAOYSA-N |
| Molecular Formula | C6H5F5O2 |
BAPTA tetraethyl ester, 98+%
CAS: 73630-07-6 Molecular Formula: C30H40N2O10 Molecular Weight (g/mol): 588.654 MDL Number: MFCD00532663 InChI Key: OLXCPQDFHUCXBA-UHFFFAOYSA-N Synonym: bapta tetraethyl ester,tetraethyl 2,2',2,2'-ethane-1,2-diylbis oxy bis 2,1-phenylene bis azanetriyl tetraacetate,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid tetraethyl ester,tetraethyl 2,2',2,2'-ethane-1,2-diylbis oxy-2,1-phenylenenitrilo tetraacetate,2-2-2-2-bis 2-ethoxy-2-oxoethyl amino phenoxy ethoxy-n-2-ethoxy-2-oxoethyl anilino acetic acid ethyl ester,ethyl 2-2-2-2-bis 2-ethoxy-2-oxidanylidene-ethyl amino phenoxy ethoxy phenyl-2-ethoxy-2-oxidanylidene-ethyl amino ethanoate,ethyl 2-2-2-2-bis 2-ethoxy-2-oxoethyl amino phenoxy ethoxy-n-2-ethoxy-2-oxoethyl anilino acetate,ethyl 2-2-2-2-bis 2-ethoxy-2-oxoethyl amino phenoxy ethoxy phenyl 2-ethoxy-2-oxoethyl amino acetate PubChem CID: 339960 IUPAC Name: ethyl 2-[2-[2-[2-[bis(2-ethoxy-2-oxoethyl)amino]phenoxy]ethoxy]-N-(2-ethoxy-2-oxoethyl)anilino]acetate SMILES: CCOC(=O)CN(CC(=O)OCC)C1=CC=CC=C1OCCOC2=CC=CC=C2N(CC(=O)OCC)CC(=O)OCC
| PubChem CID | 339960 |
|---|---|
| CAS | 73630-07-6 |
| Molecular Weight (g/mol) | 588.654 |
| MDL Number | MFCD00532663 |
| SMILES | CCOC(=O)CN(CC(=O)OCC)C1=CC=CC=C1OCCOC2=CC=CC=C2N(CC(=O)OCC)CC(=O)OCC |
| Synonym | bapta tetraethyl ester,tetraethyl 2,2',2,2'-ethane-1,2-diylbis oxy bis 2,1-phenylene bis azanetriyl tetraacetate,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid tetraethyl ester,tetraethyl 2,2',2,2'-ethane-1,2-diylbis oxy-2,1-phenylenenitrilo tetraacetate,2-2-2-2-bis 2-ethoxy-2-oxoethyl amino phenoxy ethoxy-n-2-ethoxy-2-oxoethyl anilino acetic acid ethyl ester,ethyl 2-2-2-2-bis 2-ethoxy-2-oxidanylidene-ethyl amino phenoxy ethoxy phenyl-2-ethoxy-2-oxidanylidene-ethyl amino ethanoate,ethyl 2-2-2-2-bis 2-ethoxy-2-oxoethyl amino phenoxy ethoxy-n-2-ethoxy-2-oxoethyl anilino acetate,ethyl 2-2-2-2-bis 2-ethoxy-2-oxoethyl amino phenoxy ethoxy phenyl 2-ethoxy-2-oxoethyl amino acetate |
| IUPAC Name | ethyl 2-[2-[2-[2-[bis(2-ethoxy-2-oxoethyl)amino]phenoxy]ethoxy]-N-(2-ethoxy-2-oxoethyl)anilino]acetate |
| InChI Key | OLXCPQDFHUCXBA-UHFFFAOYSA-N |
| Molecular Formula | C30H40N2O10 |