Organic acids and derivatives
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3-Hydroxy-2,2-dimethylpropionic acid, 97+%
CAS: 4835-90-9 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.132 MDL Number: MFCD00059953 InChI Key: RDFQSFOGKVZWKF-UHFFFAOYSA-N Synonym: hydroxypivalic acid,3-hydroxypivalic acid,2,2-dimethyl-3-hydroxypropionic acid,propanoic acid, 3-hydroxy-2,2-dimethyl,3-hydroxy-2,2-dimethylpropionic acid,unii-bjp2cxk56p,bjp2cxk56p,acmc-1arbc,beta-hydroxy pivalic acid PubChem CID: 78548 IUPAC Name: 3-hydroxy-2,2-dimethylpropanoic acid SMILES: CC(C)(CO)C(=O)O
| PubChem CID | 78548 |
|---|---|
| CAS | 4835-90-9 |
| Molecular Weight (g/mol) | 118.132 |
| MDL Number | MFCD00059953 |
| SMILES | CC(C)(CO)C(=O)O |
| Synonym | hydroxypivalic acid,3-hydroxypivalic acid,2,2-dimethyl-3-hydroxypropionic acid,propanoic acid, 3-hydroxy-2,2-dimethyl,3-hydroxy-2,2-dimethylpropionic acid,unii-bjp2cxk56p,bjp2cxk56p,acmc-1arbc,beta-hydroxy pivalic acid |
| IUPAC Name | 3-hydroxy-2,2-dimethylpropanoic acid |
| InChI Key | RDFQSFOGKVZWKF-UHFFFAOYSA-N |
| Molecular Formula | C5H10O3 |
Ethyl (S)-(+)-4-cyano-3-hydroxybutyrate, 97%, ee 98+%
CAS: 312745-91-8 Molecular Formula: C7H11NO3 Molecular Weight (g/mol): 157.17 MDL Number: MFCD00672878 InChI Key: LOQFROBMBSKWQY-UHFFFAOYNA-N Synonym: ethyl s-4-cyano-3-hydroxybutyrate,s-ethyl 4-cyano-3-hydroxybutanoate,ethyl 3s-4-cyano-3-hydroxybutanoate,s-ethyl-4-cyano-3-hydroxybutyrate,ethyl s-+-4-cyano-3-hydroxybutyrate,butanoic acid, 4-cyano-3-hydroxy-, ethyl ester, 3s,4-cyano-3-hydroxy-butyric acid ethyl ester,pubchem21112 PubChem CID: 7020868 IUPAC Name: ethyl (3S)-4-cyano-3-hydroxybutanoate SMILES: CCOC(=O)CC(O)CC#N
| PubChem CID | 7020868 |
|---|---|
| CAS | 312745-91-8 |
| Molecular Weight (g/mol) | 157.17 |
| MDL Number | MFCD00672878 |
| SMILES | CCOC(=O)CC(O)CC#N |
| Synonym | ethyl s-4-cyano-3-hydroxybutyrate,s-ethyl 4-cyano-3-hydroxybutanoate,ethyl 3s-4-cyano-3-hydroxybutanoate,s-ethyl-4-cyano-3-hydroxybutyrate,ethyl s-+-4-cyano-3-hydroxybutyrate,butanoic acid, 4-cyano-3-hydroxy-, ethyl ester, 3s,4-cyano-3-hydroxy-butyric acid ethyl ester,pubchem21112 |
| IUPAC Name | ethyl (3S)-4-cyano-3-hydroxybutanoate |
| InChI Key | LOQFROBMBSKWQY-UHFFFAOYNA-N |
| Molecular Formula | C7H11NO3 |
Sodium Tartrate, Dihydrate, Crystal, Reagent, ACS, 99-101%, Spectrum™ Chemical
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CAS: 6106-24-7 Molecular Formula: C4H8Na2O8 Molecular Weight (g/mol): 230.08 MDL Number: MFCD00150035 InChI Key: FGJLAJMGHXGFDE-UDMGOBQRNA-L IUPAC Name: disodium (2R,3R)-2,3-dihydroxybutanedioate dihydrate SMILES: O.O.[Na+].[Na+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O
| CAS | 6106-24-7 |
|---|---|
| Molecular Weight (g/mol) | 230.08 |
| MDL Number | MFCD00150035 |
| SMILES | O.O.[Na+].[Na+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O |
| IUPAC Name | disodium (2R,3R)-2,3-dihydroxybutanedioate dihydrate |
| InChI Key | FGJLAJMGHXGFDE-UDMGOBQRNA-L |
| Molecular Formula | C4H8Na2O8 |
Potassium Sodium Tartrate, Tetrahydrate, Granular, USP, 99-102%, Spectrum™ Chemical
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CAS: 6381-59-5 Molecular Formula: C4H12KNaO10 Molecular Weight (g/mol): 282.22 InChI Key: VZOPRCCTKLAGPN-ZFJVMAEJSA-L IUPAC Name: potassium sodium (2R,3R)-2,3-dihydroxybutanedioate tetrahydrate SMILES: O.O.O.O.[Na+].[K+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O
| CAS | 6381-59-5 |
|---|---|
| Molecular Weight (g/mol) | 282.22 |
| SMILES | O.O.O.O.[Na+].[K+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O |
| IUPAC Name | potassium sodium (2R,3R)-2,3-dihydroxybutanedioate tetrahydrate |
| InChI Key | VZOPRCCTKLAGPN-ZFJVMAEJSA-L |
| Molecular Formula | C4H12KNaO10 |
N-Boc-2-methyl-L-serine, 97%
CAS: 84311-19-3 Molecular Formula: C9H17NO5 Molecular Weight (g/mol): 219.24 MDL Number: MFCD02682593 InChI Key: FWRXDSRYWWYTPD-VIFPVBQESA-N Synonym: n-boc-alpha-methyl-l-serine,s-2-tert-butoxycarbonyl amino-3-hydroxy-2-methylpropanoic acid,boc-alpha-methyl-l-ser,2s-2-tert-butoxycarbonyl amino-3-hydroxy-2-methylpropanoic acid,s-2-boc-amino-3-hydroxy-2-methylpropionic acid,n-1,1-dimethylethyl oxy carbonyl-2-methylserine,serine, n-1,1-dimethylethoxy carbonyl-2-methyl,s-2-tert-butoxycarbonylamino-3-hydroxy-2-methylpropanoic acid,n-boc-a-methylserine,boc-a-methyl-l-ser PubChem CID: 12991620 IUPAC Name: (2S)-3-hydroxy-2-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid SMILES: CC(C)(C)OC(=O)N[C@@](C)(CO)C(O)=O
| PubChem CID | 12991620 |
|---|---|
| CAS | 84311-19-3 |
| Molecular Weight (g/mol) | 219.24 |
| MDL Number | MFCD02682593 |
| SMILES | CC(C)(C)OC(=O)N[C@@](C)(CO)C(O)=O |
| Synonym | n-boc-alpha-methyl-l-serine,s-2-tert-butoxycarbonyl amino-3-hydroxy-2-methylpropanoic acid,boc-alpha-methyl-l-ser,2s-2-tert-butoxycarbonyl amino-3-hydroxy-2-methylpropanoic acid,s-2-boc-amino-3-hydroxy-2-methylpropionic acid,n-1,1-dimethylethyl oxy carbonyl-2-methylserine,serine, n-1,1-dimethylethoxy carbonyl-2-methyl,s-2-tert-butoxycarbonylamino-3-hydroxy-2-methylpropanoic acid,n-boc-a-methylserine,boc-a-methyl-l-ser |
| IUPAC Name | (2S)-3-hydroxy-2-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid |
| InChI Key | FWRXDSRYWWYTPD-VIFPVBQESA-N |
| Molecular Formula | C9H17NO5 |
Ethyl (S)-(-)-4-chloro-3-hydroxybutyrate, 98%
CAS: 86728-85-0 Molecular Formula: C6H11ClO3 Molecular Weight (g/mol): 166.60 MDL Number: MFCD00211241 InChI Key: ZAJNMXDBJKCCAT-YFKPBYRVSA-N Synonym: ethyl s-4-chloro-3-hydroxybutyrate,ethyl s---4-chloro-3-hydroxybutyrate,ethyl s---4-chloro-3-hydroxybutanoate,ethyl 3s-4-chloro-3-hydroxybutanoate,ethyl s-4-chloro-3-hydroxybutanoate,s-4-chloro-3-hydroxybutyrate,s-4-chloro-3-hydroxybutyric acid ethyl ester,s-4-chloro-3-hydroxy-n-butyric acid ethyl ester,s-ethyl 4-chloro-3-hydroxybutanoate PubChem CID: 7019277 IUPAC Name: ethyl (3S)-4-chloro-3-hydroxybutanoate SMILES: CCOC(=O)C[C@H](O)CCl
| PubChem CID | 7019277 |
|---|---|
| CAS | 86728-85-0 |
| Molecular Weight (g/mol) | 166.60 |
| MDL Number | MFCD00211241 |
| SMILES | CCOC(=O)C[C@H](O)CCl |
| Synonym | ethyl s-4-chloro-3-hydroxybutyrate,ethyl s---4-chloro-3-hydroxybutyrate,ethyl s---4-chloro-3-hydroxybutanoate,ethyl 3s-4-chloro-3-hydroxybutanoate,ethyl s-4-chloro-3-hydroxybutanoate,s-4-chloro-3-hydroxybutyrate,s-4-chloro-3-hydroxybutyric acid ethyl ester,s-4-chloro-3-hydroxy-n-butyric acid ethyl ester,s-ethyl 4-chloro-3-hydroxybutanoate |
| IUPAC Name | ethyl (3S)-4-chloro-3-hydroxybutanoate |
| InChI Key | ZAJNMXDBJKCCAT-YFKPBYRVSA-N |
| Molecular Formula | C6H11ClO3 |
Ethyl 1-(hydroxymethyl)cyclopropanecarboxylate, 95%
CAS: 3697-68-5 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD09759206 InChI Key: PAILVKQSHRJIPE-UHFFFAOYSA-N Synonym: ethyl 1-hydroxymethyl cyclopropanecarboxylate,ethyl 1-hydroxymethyl-cyclopropanecarboxylate,1-hydroxymethyl-cyclopropanecarboxylic acid ethyl ester,ethyl 1-hydroxymethyl cyclopropane-1-carboxylate,ethyl 1-hydroxymethylcyclopropanecarboxylate,ethyl1-hydroxymethyl-cyclopropanecarboxylate,ethyl 1-hydroxymethyl-1-cyclopropanecarboxylate,1-hydroxymethyl-cyclopropanecarboxylic acid ethyl,1-hydroxymethylcyclopropanecarboxylic acid ethyl ester,1-hydroxymethyl cyclopropane carboxylic acid ethyl ester PubChem CID: 12450336 IUPAC Name: ethyl 1-(hydroxymethyl)cyclopropane-1-carboxylate SMILES: CCOC(=O)C1(CO)CC1
| PubChem CID | 12450336 |
|---|---|
| CAS | 3697-68-5 |
| Molecular Weight (g/mol) | 144.17 |
| MDL Number | MFCD09759206 |
| SMILES | CCOC(=O)C1(CO)CC1 |
| Synonym | ethyl 1-hydroxymethyl cyclopropanecarboxylate,ethyl 1-hydroxymethyl-cyclopropanecarboxylate,1-hydroxymethyl-cyclopropanecarboxylic acid ethyl ester,ethyl 1-hydroxymethyl cyclopropane-1-carboxylate,ethyl 1-hydroxymethylcyclopropanecarboxylate,ethyl1-hydroxymethyl-cyclopropanecarboxylate,ethyl 1-hydroxymethyl-1-cyclopropanecarboxylate,1-hydroxymethyl-cyclopropanecarboxylic acid ethyl,1-hydroxymethylcyclopropanecarboxylic acid ethyl ester,1-hydroxymethyl cyclopropane carboxylic acid ethyl ester |
| IUPAC Name | ethyl 1-(hydroxymethyl)cyclopropane-1-carboxylate |
| InChI Key | PAILVKQSHRJIPE-UHFFFAOYSA-N |
| Molecular Formula | C7H12O3 |
Methyl (R)-(-)-β-hydroxyisobutyrate, 98%, Thermo Scientific Chemicals
CAS: 72657-23-9 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.13 MDL Number: MFCD00063450 InChI Key: ATCCIZURPPEVIZ-SCSAIBSYSA-N Synonym: r-methyl 3-hydroxy-2-methylpropanoate,r---3-hydroxy-2-methylpropionic acid methyl ester,methyl r---3-hydroxy-2-methylpropionate,--methyl d-beta-hydroxyisobutyrate,methyl r---3-hydroxyisobutyrate,roche ester,methyl r-3-hydroxy-2-methylpropionate,propanoic acid, 3-hydroxy-2-methyl-, methyl ester, 2r,methyl 2r-3-hydroxy-2-methylpropanoate,r---3-hydroxyisobutyric acid methyl ester PubChem CID: 5324733 IUPAC Name: methyl (2R)-3-hydroxy-2-methylpropanoate SMILES: CC(CO)C(=O)OC
| PubChem CID | 5324733 |
|---|---|
| CAS | 72657-23-9 |
| Molecular Weight (g/mol) | 118.13 |
| MDL Number | MFCD00063450 |
| SMILES | CC(CO)C(=O)OC |
| Synonym | r-methyl 3-hydroxy-2-methylpropanoate,r---3-hydroxy-2-methylpropionic acid methyl ester,methyl r---3-hydroxy-2-methylpropionate,--methyl d-beta-hydroxyisobutyrate,methyl r---3-hydroxyisobutyrate,roche ester,methyl r-3-hydroxy-2-methylpropionate,propanoic acid, 3-hydroxy-2-methyl-, methyl ester, 2r,methyl 2r-3-hydroxy-2-methylpropanoate,r---3-hydroxyisobutyric acid methyl ester |
| IUPAC Name | methyl (2R)-3-hydroxy-2-methylpropanoate |
| InChI Key | ATCCIZURPPEVIZ-SCSAIBSYSA-N |
| Molecular Formula | C5H10O3 |
Diethyl bis(hydroxymethyl)malonate, 95%
CAS: 20605-01-0 Molecular Formula: C9H16O6 Molecular Weight (g/mol): 220.22 MDL Number: MFCD00009130 InChI Key: WIOHBOKEUIHYIC-UHFFFAOYSA-N Synonym: diethyl bis hydroxymethyl malonate,diethyl 2,2-bis hydroxymethyl malonate,propanedioic acid, bis hydroxymethyl-, diethyl ester,1,3-diethyl 2,2-bis hydroxymethyl propanedioate,diethyl 2,2-bis hydroxymethyl propanedioate,2,2-bis hydroxymethyl malonic acid diethyl ester,bis hydroxymethyl malonic acid diethyl ester,diethyl 2,2-bis hydroxymethyl propane-1,3-dioate,acmc-20al8x,ksc490a8h PubChem CID: 311844 IUPAC Name: diethyl 2,2-bis(hydroxymethyl)propanedioate SMILES: CCOC(=O)C(CO)(CO)C(=O)OCC
| PubChem CID | 311844 |
|---|---|
| CAS | 20605-01-0 |
| Molecular Weight (g/mol) | 220.22 |
| MDL Number | MFCD00009130 |
| SMILES | CCOC(=O)C(CO)(CO)C(=O)OCC |
| Synonym | diethyl bis hydroxymethyl malonate,diethyl 2,2-bis hydroxymethyl malonate,propanedioic acid, bis hydroxymethyl-, diethyl ester,1,3-diethyl 2,2-bis hydroxymethyl propanedioate,diethyl 2,2-bis hydroxymethyl propanedioate,2,2-bis hydroxymethyl malonic acid diethyl ester,bis hydroxymethyl malonic acid diethyl ester,diethyl 2,2-bis hydroxymethyl propane-1,3-dioate,acmc-20al8x,ksc490a8h |
| IUPAC Name | diethyl 2,2-bis(hydroxymethyl)propanedioate |
| InChI Key | WIOHBOKEUIHYIC-UHFFFAOYSA-N |
| Molecular Formula | C9H16O6 |
Sodium Gluconate, USP, 98-102%, Spectrum™ Chemical
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CAS: 527-07-1 Molecular Formula: C6H11NaO7 Molecular Weight (g/mol): 218.14 InChI Key: UPMFZISCCZSDND-UHFFFAOYNA-M IUPAC Name: sodium 2,3,4,5,6-pentahydroxyhexanoate SMILES: [Na+].OCC(O)C(O)C(O)C(O)C([O-])=O
| CAS | 527-07-1 |
|---|---|
| Molecular Weight (g/mol) | 218.14 |
| SMILES | [Na+].OCC(O)C(O)C(O)C(O)C([O-])=O |
| IUPAC Name | sodium 2,3,4,5,6-pentahydroxyhexanoate |
| InChI Key | UPMFZISCCZSDND-UHFFFAOYNA-M |
| Molecular Formula | C6H11NaO7 |
Sodium Tartrate, Dihydrate, Purified, Spectrum™ Chemical
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CAS: 6106-24-7 Molecular Formula: C4H8Na2O8 Molecular Weight (g/mol): 230.08 MDL Number: MFCD00150035 InChI Key: FGJLAJMGHXGFDE-UDMGOBQRNA-L IUPAC Name: disodium (2R,3R)-2,3-dihydroxybutanedioate dihydrate SMILES: O.O.[Na+].[Na+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O
| CAS | 6106-24-7 |
|---|---|
| Molecular Weight (g/mol) | 230.08 |
| MDL Number | MFCD00150035 |
| SMILES | O.O.[Na+].[Na+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O |
| IUPAC Name | disodium (2R,3R)-2,3-dihydroxybutanedioate dihydrate |
| InChI Key | FGJLAJMGHXGFDE-UDMGOBQRNA-L |
| Molecular Formula | C4H8Na2O8 |
Methyl (S)-(+)-3-hydroxy-2-methylpropionate, 98%
CAS: 80657-57-4 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.13 MDL Number: MFCD00064520 InChI Key: ATCCIZURPPEVIZ-UHFFFAOYNA-N Synonym: s-methyl 3-hydroxy-2-methylpropanoate,methyl s-+-3-hydroxy-2-methylpropionate,s-+-3-hydroxy-2-methylpropionic acid methyl ester,methyl 2s-3-hydroxy-2-methylpropanoate,2-methyl-3-hydroxypropanoic acid,propanoic acid, 3-hydroxy-2-methyl-, methyl ester, 2s,s-+-methyl 3-hydroxy-2-methylpropionate,s-3-hydroxy-2-methylpropionic acid methyl ester,+-methyl l-beta-hydroxyisobutyrate,methyl 3-hydroxy-2-methylpropanoate # PubChem CID: 10192563 IUPAC Name: methyl (2S)-3-hydroxy-2-methylpropanoate SMILES: COC(=O)C(C)CO
| PubChem CID | 10192563 |
|---|---|
| CAS | 80657-57-4 |
| Molecular Weight (g/mol) | 118.13 |
| MDL Number | MFCD00064520 |
| SMILES | COC(=O)C(C)CO |
| Synonym | s-methyl 3-hydroxy-2-methylpropanoate,methyl s-+-3-hydroxy-2-methylpropionate,s-+-3-hydroxy-2-methylpropionic acid methyl ester,methyl 2s-3-hydroxy-2-methylpropanoate,2-methyl-3-hydroxypropanoic acid,propanoic acid, 3-hydroxy-2-methyl-, methyl ester, 2s,s-+-methyl 3-hydroxy-2-methylpropionate,s-3-hydroxy-2-methylpropionic acid methyl ester,+-methyl l-beta-hydroxyisobutyrate,methyl 3-hydroxy-2-methylpropanoate # |
| IUPAC Name | methyl (2S)-3-hydroxy-2-methylpropanoate |
| InChI Key | ATCCIZURPPEVIZ-UHFFFAOYNA-N |
| Molecular Formula | C5H10O3 |
Ethyl 3-hydroxyhexanoate, 97%
CAS: 2305-25-1 Molecular Formula: C8H16O3 Molecular Weight (g/mol): 160.213 MDL Number: MFCD00036604 InChI Key: LYRIITRHDCNUHV-UHFFFAOYSA-N Synonym: hexanoic acid, 3-hydroxy-, ethyl ester,ethyl beta-hydroxycaproate,ethyl 3-hydroxy-hexanoate,ethyl hydroxy-3-hexanoate,3-hydroxyhexanoic acid ethyl ester,fema no. 3545,acmc-20lakf,ethyl 3-hydroxycaproate,ethyl-3-hydrixyhexanoate,ethyl 3-hydroxy hexanoate PubChem CID: 61293 ChEBI: CHEBI:23997 IUPAC Name: ethyl 3-hydroxyhexanoate SMILES: CCCC(CC(=O)OCC)O
| PubChem CID | 61293 |
|---|---|
| CAS | 2305-25-1 |
| Molecular Weight (g/mol) | 160.213 |
| ChEBI | CHEBI:23997 |
| MDL Number | MFCD00036604 |
| SMILES | CCCC(CC(=O)OCC)O |
| Synonym | hexanoic acid, 3-hydroxy-, ethyl ester,ethyl beta-hydroxycaproate,ethyl 3-hydroxy-hexanoate,ethyl hydroxy-3-hexanoate,3-hydroxyhexanoic acid ethyl ester,fema no. 3545,acmc-20lakf,ethyl 3-hydroxycaproate,ethyl-3-hydrixyhexanoate,ethyl 3-hydroxy hexanoate |
| IUPAC Name | ethyl 3-hydroxyhexanoate |
| InChI Key | LYRIITRHDCNUHV-UHFFFAOYSA-N |
| Molecular Formula | C8H16O3 |
Methyl 2-(hydroxymethyl)acrylate, 85%, stabilized with 0.1 wt.% MEHQ
CAS: 15484-46-5 Molecular Formula: C5H8O3 Molecular Weight (g/mol): 116.12 MDL Number: MFCD12545894 InChI Key: RFUCOAQWQVDBEU-UHFFFAOYSA-N Synonym: methyl 2-hydroxymethyl acrylate,methyl 2-hydroxymethyl prop-2-enoate,methyl2-hydroxymethyl acrylate,methyl-2-hydroxymethyl-acrylate,pubchem17373,methyl 2-hydroxymethylacrylate,methyl alpha-hydroxymethylacrylate,2-hydroxymethylacrylate methyl ester,2-methylolacrylic acid methyl ester,methyl alpha-hydroxymethyl acrylate PubChem CID: 11815329 IUPAC Name: methyl 2-(hydroxymethyl)prop-2-enoate SMILES: COC(=O)C(=C)CO
| PubChem CID | 11815329 |
|---|---|
| CAS | 15484-46-5 |
| Molecular Weight (g/mol) | 116.12 |
| MDL Number | MFCD12545894 |
| SMILES | COC(=O)C(=C)CO |
| Synonym | methyl 2-hydroxymethyl acrylate,methyl 2-hydroxymethyl prop-2-enoate,methyl2-hydroxymethyl acrylate,methyl-2-hydroxymethyl-acrylate,pubchem17373,methyl 2-hydroxymethylacrylate,methyl alpha-hydroxymethylacrylate,2-hydroxymethylacrylate methyl ester,2-methylolacrylic acid methyl ester,methyl alpha-hydroxymethyl acrylate |
| IUPAC Name | methyl 2-(hydroxymethyl)prop-2-enoate |
| InChI Key | RFUCOAQWQVDBEU-UHFFFAOYSA-N |
| Molecular Formula | C5H8O3 |