Organic acids and derivatives























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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 |
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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 |
3-Methyl-2-oxobutanoic acid, sodium salt, 98+%
CAS: 3715-29-5 Molecular Formula: C5H7NaO3 Molecular Weight (g/mol): 138.1 MDL Number: MFCD00002581 InChI Key: WIQBZDCJCRFGKA-UHFFFAOYSA-M Synonym: sodium 3-methyl-2-oxobutanoate,ketovaline sodium salt,unii-5om3h751iu,butanoic acid, 3-methyl-2-oxo-, sodium salt,3-methyl-2-oxobutyric acid sodium salt,2-ketoisovaleric acid sodium salt,sodium 3-methyl-2-oxobutyrate,3-methyl-2-oxobutanoic acid sodium salt,sodium dimethylpyruvate,ketovaline sodium PubChem CID: 2724059 IUPAC Name: sodium;3-methyl-2-oxobutanoate SMILES: CC(C)C(=O)C(=O)[O-].[Na+]

PubChem CID | 2724059 |
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CAS | 3715-29-5 |
Molecular Weight (g/mol) | 138.1 |
MDL Number | MFCD00002581 |
SMILES | CC(C)C(=O)C(=O)[O-].[Na+] |
Synonym | sodium 3-methyl-2-oxobutanoate,ketovaline sodium salt,unii-5om3h751iu,butanoic acid, 3-methyl-2-oxo-, sodium salt,3-methyl-2-oxobutyric acid sodium salt,2-ketoisovaleric acid sodium salt,sodium 3-methyl-2-oxobutyrate,3-methyl-2-oxobutanoic acid sodium salt,sodium dimethylpyruvate,ketovaline sodium |
IUPAC Name | sodium;3-methyl-2-oxobutanoate |
InChI Key | WIQBZDCJCRFGKA-UHFFFAOYSA-M |
Molecular Formula | C5H7NaO3 |
Benzamide, 99%
CAS: 55-21-0 Molecular Formula: C7H7NO Molecular Weight (g/mol): 121.14 MDL Number: MFCD00007968 InChI Key: KXDAEFPNCMNJSK-UHFFFAOYSA-N Synonym: benzoic acid amide,benzoylamide,phenylcarboxyamide,phenylcarboxamide,benzenecarboxamide,amid kyseliny benzoove,amid kyseliny benzoove czech,phenyl carboxyamide,ccris 4594,benzoic acid,amide PubChem CID: 2331 ChEBI: CHEBI:28179 IUPAC Name: benzamide SMILES: C1=CC=C(C=C1)C(=O)N

PubChem CID | 2331 |
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CAS | 55-21-0 |
Molecular Weight (g/mol) | 121.14 |
ChEBI | CHEBI:28179 |
MDL Number | MFCD00007968 |
SMILES | C1=CC=C(C=C1)C(=O)N |
Synonym | benzoic acid amide,benzoylamide,phenylcarboxyamide,phenylcarboxamide,benzenecarboxamide,amid kyseliny benzoove,amid kyseliny benzoove czech,phenyl carboxyamide,ccris 4594,benzoic acid,amide |
IUPAC Name | benzamide |
InChI Key | KXDAEFPNCMNJSK-UHFFFAOYSA-N |
Molecular Formula | C7H7NO |
Propionamide, 97%
CAS: 79-05-0 Molecular Formula: C3H7NO Molecular Weight (g/mol): 73.09 MDL Number: MFCD00008039 InChI Key: QLNJFJADRCOGBJ-UHFFFAOYSA-N Synonym: propionamide,propylamide,propionic amide,propionimidic acid,propanimidic acid,propionic acid amide,amid kyseliny propionove,propanimidic acid van,propionimidic acid van,unii-qk07g0hp47 PubChem CID: 6578 ChEBI: CHEBI:45422 IUPAC Name: propanamide SMILES: CCC(=O)N

PubChem CID | 6578 |
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CAS | 79-05-0 |
Molecular Weight (g/mol) | 73.09 |
ChEBI | CHEBI:45422 |
MDL Number | MFCD00008039 |
SMILES | CCC(=O)N |
Synonym | propionamide,propylamide,propionic amide,propionimidic acid,propanimidic acid,propionic acid amide,amid kyseliny propionove,propanimidic acid van,propionimidic acid van,unii-qk07g0hp47 |
IUPAC Name | propanamide |
InChI Key | QLNJFJADRCOGBJ-UHFFFAOYSA-N |
Molecular Formula | C3H7NO |
Methyl 3-mercaptopropionate, 98%
CAS: 2935-90-2 Molecular Formula: C4H8O2S Molecular Weight (g/mol): 120.17 MDL Number: MFCD00004895 InChI Key: LDTLDBDUBGAEDT-UHFFFAOYSA-N PubChem CID: 18050 IUPAC Name: methyl 3-sulfanylpropanoate SMILES: COC(=O)CCS

PubChem CID | 18050 |
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CAS | 2935-90-2 |
Molecular Weight (g/mol) | 120.17 |
MDL Number | MFCD00004895 |
SMILES | COC(=O)CCS |
IUPAC Name | methyl 3-sulfanylpropanoate |
InChI Key | LDTLDBDUBGAEDT-UHFFFAOYSA-N |
Molecular Formula | C4H8O2S |
Mercaptoacetic acid, sodium salt, 98%
CAS: 367-51-1 Molecular Formula: C2H3NaO2S Molecular Weight (g/mol): 114.09 MDL Number: MFCD00043386 InChI Key: GNBVPFITFYNRCN-UHFFFAOYSA-M Synonym: sodium thioglycolate,sodium mercaptoacetate,mercaptoacetic acid sodium salt,mollescal sf,sodium 2-sulfanylacetate,thioglycolate sodium,sodium thioglycollate,mercaptoacetic acid, sodium salt,erhavit d,sodium 2-mercatoethanoate PubChem CID: 23690444 ChEBI: CHEBI:86481 IUPAC Name: sodium;2-sulfanylacetate SMILES: C(C(=O)[O-])S.[Na+]

PubChem CID | 23690444 |
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CAS | 367-51-1 |
Molecular Weight (g/mol) | 114.09 |
ChEBI | CHEBI:86481 |
MDL Number | MFCD00043386 |
SMILES | C(C(=O)[O-])S.[Na+] |
Synonym | sodium thioglycolate,sodium mercaptoacetate,mercaptoacetic acid sodium salt,mollescal sf,sodium 2-sulfanylacetate,thioglycolate sodium,sodium thioglycollate,mercaptoacetic acid, sodium salt,erhavit d,sodium 2-mercatoethanoate |
IUPAC Name | sodium;2-sulfanylacetate |
InChI Key | GNBVPFITFYNRCN-UHFFFAOYSA-M |
Molecular Formula | C2H3NaO2S |
1,1,3,3-Tetramethylurea, 99%
CAS: 632-22-4 Molecular Formula: C5H12N2O Molecular Weight (g/mol): 116.16 MDL Number: MFCD00008319 InChI Key: AVQQQNCBBIEMEU-UHFFFAOYSA-N Synonym: tetramethylurea,temur,urea, tetramethyl,n,n,n',n'-tetramethylurea,tetramethyluree,tmu,urea, 1,1,3,3-tetramethyl,urea, n,n,n',n'-tetramethyl,tetramethyluree french,tetramethyl-urea PubChem CID: 12437 ChEBI: CHEBI:84278 IUPAC Name: 1,1,3,3-tetramethylurea SMILES: CN(C)C(=O)N(C)C

PubChem CID | 12437 |
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CAS | 632-22-4 |
Molecular Weight (g/mol) | 116.16 |
ChEBI | CHEBI:84278 |
MDL Number | MFCD00008319 |
SMILES | CN(C)C(=O)N(C)C |
Synonym | tetramethylurea,temur,urea, tetramethyl,n,n,n',n'-tetramethylurea,tetramethyluree,tmu,urea, 1,1,3,3-tetramethyl,urea, n,n,n',n'-tetramethyl,tetramethyluree french,tetramethyl-urea |
IUPAC Name | 1,1,3,3-tetramethylurea |
InChI Key | AVQQQNCBBIEMEU-UHFFFAOYSA-N |
Molecular Formula | C5H12N2O |
p-Tolylacetic acid, 99%
CAS: 622-47-9 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00004353 InChI Key: GXXXUZIRGXYDFP-UHFFFAOYSA-N Synonym: p-tolylacetic acid,4-methylphenylacetic acid,2-p-tolyl acetic acid,2-4-methylphenyl acetic acid,p-methylphenylacetic acid,4-tolylacetic acid,4-methylphenyl acetic acid,benzeneacetic acid, 4-methyl,acetic acid, p-tolyl,2-p-tolylacetic acid PubChem CID: 248474 IUPAC Name: 2-(4-methylphenyl)acetic acid SMILES: CC1=CC=C(C=C1)CC(=O)O

PubChem CID | 248474 |
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CAS | 622-47-9 |
Molecular Weight (g/mol) | 150.18 |
MDL Number | MFCD00004353 |
SMILES | CC1=CC=C(C=C1)CC(=O)O |
Synonym | p-tolylacetic acid,4-methylphenylacetic acid,2-p-tolyl acetic acid,2-4-methylphenyl acetic acid,p-methylphenylacetic acid,4-tolylacetic acid,4-methylphenyl acetic acid,benzeneacetic acid, 4-methyl,acetic acid, p-tolyl,2-p-tolylacetic acid |
IUPAC Name | 2-(4-methylphenyl)acetic acid |
InChI Key | GXXXUZIRGXYDFP-UHFFFAOYSA-N |
Molecular Formula | C9H10O2 |
N-(4-Bromobutyl)phthalimide, 98%
CAS: 5394-18-3 Molecular Formula: C12H12BrNO2 Molecular Weight (g/mol): 282.14 MDL Number: MFCD00005905 InChI Key: UXFWTIGUWHJKDD-UHFFFAOYSA-N Synonym: n-4-bromobutyl phthalimide,2-4-bromobutyl isoindoline-1,3-dione,1h-isoindole-1,3 2h-dione, 2-4-bromobutyl,2-4-bromobutyl-1h-isoindole-1,3 2h-dione,n-4-bromobutyl-phthalimide,2-4-bromobutyl isoindole-1,3-dione,2-4-bromobutyl-2,3-dihydro-1h-isoindole-1,3-dione,n-4-bromobutyl,n-bromobutylphthalimide PubChem CID: 93575 IUPAC Name: 2-(4-bromobutyl)isoindole-1,3-dione SMILES: BrCCCCN1C(=O)C2=CC=CC=C2C1=O

PubChem CID | 93575 |
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CAS | 5394-18-3 |
Molecular Weight (g/mol) | 282.14 |
MDL Number | MFCD00005905 |
SMILES | BrCCCCN1C(=O)C2=CC=CC=C2C1=O |
Synonym | n-4-bromobutyl phthalimide,2-4-bromobutyl isoindoline-1,3-dione,1h-isoindole-1,3 2h-dione, 2-4-bromobutyl,2-4-bromobutyl-1h-isoindole-1,3 2h-dione,n-4-bromobutyl-phthalimide,2-4-bromobutyl isoindole-1,3-dione,2-4-bromobutyl-2,3-dihydro-1h-isoindole-1,3-dione,n-4-bromobutyl,n-bromobutylphthalimide |
IUPAC Name | 2-(4-bromobutyl)isoindole-1,3-dione |
InChI Key | UXFWTIGUWHJKDD-UHFFFAOYSA-N |
Molecular Formula | C12H12BrNO2 |
Glycine anhydride, 98%
CAS: 106-57-0 Molecular Formula: C4H6N2O2 Molecular Weight (g/mol): 114.1 MDL Number: MFCD00006009 InChI Key: BXRNXXXXHLBUKK-UHFFFAOYSA-N Synonym: 2,5-piperazinedione,2,5-dioxopiperazine,2,5-diketopiperazine,cyclodiglycine,cycloglycylglycine,cyclo glycylglycyl,glycylglycine lactam,diglycolyl diamide,glycine, bimol. cyclic peptide,alpha,gamma-diacipiperazine PubChem CID: 7817 ChEBI: CHEBI:16535 IUPAC Name: piperazine-2,5-dione SMILES: C1C(=O)NCC(=O)N1

PubChem CID | 7817 |
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CAS | 106-57-0 |
Molecular Weight (g/mol) | 114.1 |
ChEBI | CHEBI:16535 |
MDL Number | MFCD00006009 |
SMILES | C1C(=O)NCC(=O)N1 |
Synonym | 2,5-piperazinedione,2,5-dioxopiperazine,2,5-diketopiperazine,cyclodiglycine,cycloglycylglycine,cyclo glycylglycyl,glycylglycine lactam,diglycolyl diamide,glycine, bimol. cyclic peptide,alpha,gamma-diacipiperazine |
IUPAC Name | piperazine-2,5-dione |
InChI Key | BXRNXXXXHLBUKK-UHFFFAOYSA-N |
Molecular Formula | C4H6N2O2 |
Hypoxanthine, 99.5%
CAS: 68-94-0 Molecular Formula: C5H4N4O Molecular Weight (g/mol): 136.11 MDL Number: MFCD00005725 InChI Key: FDGQSTZJBFJUBT-UHFFFAOYSA-N Synonym: hypoxanthine,6-hydroxypurine,9h-purin-6-ol,sarkin,6-oxopurine,sarcine,sarkine,3h-purin-6-ol,7h-purin-6-ol,purin-6 1h-one PubChem CID: 790 ChEBI: CHEBI:17368 SMILES: O=C1N=CNC2=C1NC=N2

PubChem CID | 790 |
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CAS | 68-94-0 |
Molecular Weight (g/mol) | 136.11 |
ChEBI | CHEBI:17368 |
MDL Number | MFCD00005725 |
SMILES | O=C1N=CNC2=C1NC=N2 |
Synonym | hypoxanthine,6-hydroxypurine,9h-purin-6-ol,sarkin,6-oxopurine,sarcine,sarkine,3h-purin-6-ol,7h-purin-6-ol,purin-6 1h-one |
InChI Key | FDGQSTZJBFJUBT-UHFFFAOYSA-N |
Molecular Formula | C5H4N4O |
Isoamyl acetate, 99%, pure, mixture of 2- and 3-Methylbutyl acetate
CAS: 123-92-2 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.19 MDL Number: MFCD00008946 InChI Key: MLFHJEHSLIIPHL-UHFFFAOYSA-N Synonym: isoamyl acetate,isopentyl acetate,isopentyl ethanoate,banana oil,pear oil,3-methylbutyl ethanoate,isoamyl ethanoate,iso-amyl acetate,3-methyl-1-butyl acetate,i-amyl acetate PubChem CID: 31276 ChEBI: CHEBI:31725 IUPAC Name: 3-methylbutyl acetate SMILES: CC(C)CCOC(C)=O

PubChem CID | 31276 |
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CAS | 123-92-2 |
Molecular Weight (g/mol) | 130.19 |
ChEBI | CHEBI:31725 |
MDL Number | MFCD00008946 |
SMILES | CC(C)CCOC(C)=O |
Synonym | isoamyl acetate,isopentyl acetate,isopentyl ethanoate,banana oil,pear oil,3-methylbutyl ethanoate,isoamyl ethanoate,iso-amyl acetate,3-methyl-1-butyl acetate,i-amyl acetate |
IUPAC Name | 3-methylbutyl acetate |
InChI Key | MLFHJEHSLIIPHL-UHFFFAOYSA-N |
Molecular Formula | C7H14O2 |
1,2-Bis(2-aminophenoxy)-ethane-N,N,N'N'-tetraacetic acid, 97%
CAS: 85233-19-8 Molecular Formula: C22H24N2O10 Molecular Weight (g/mol): 476.44 MDL Number: MFCD00036255 InChI Key: FTEDXVNDVHYDQW-UHFFFAOYSA-N Synonym: bapta,bapeta,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid,ca ii-bapta,1,2-bis-2-aminophenoxy ethane n,n,n',n'-tetraacetic acid,unii-k22ddw77c0,1,2-bis o-aminophenoxy ethane-n,n,n',n'-tetraacetic acid,bapta tetrasodium salt hydrate,glycine, n,n'-1,2-ethanediylbis oxy-2,1-phenylene bis n-carboxymethyl,2,2',2,2'-ethane-1,2-diylbis oxy-2,1-phenylenenitrilo tetraacetic acid PubChem CID: 104751 ChEBI: CHEBI:60888 IUPAC Name: 2-{[2-(2-{2-[bis(carboxymethyl)amino]phenoxy}ethoxy)phenyl](carboxymethyl)amino}acetic acid SMILES: OC(=O)CN(CC(O)=O)C1=CC=CC=C1OCCOC1=CC=CC=C1N(CC(O)=O)CC(O)=O

PubChem CID | 104751 |
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CAS | 85233-19-8 |
Molecular Weight (g/mol) | 476.44 |
ChEBI | CHEBI:60888 |
MDL Number | MFCD00036255 |
SMILES | OC(=O)CN(CC(O)=O)C1=CC=CC=C1OCCOC1=CC=CC=C1N(CC(O)=O)CC(O)=O |
Synonym | bapta,bapeta,1,2-bis 2-aminophenoxy ethane-n,n,n',n'-tetraacetic acid,ca ii-bapta,1,2-bis-2-aminophenoxy ethane n,n,n',n'-tetraacetic acid,unii-k22ddw77c0,1,2-bis o-aminophenoxy ethane-n,n,n',n'-tetraacetic acid,bapta tetrasodium salt hydrate,glycine, n,n'-1,2-ethanediylbis oxy-2,1-phenylene bis n-carboxymethyl,2,2',2,2'-ethane-1,2-diylbis oxy-2,1-phenylenenitrilo tetraacetic acid |
IUPAC Name | 2-{[2-(2-{2-[bis(carboxymethyl)amino]phenoxy}ethoxy)phenyl](carboxymethyl)amino}acetic acid |
InChI Key | FTEDXVNDVHYDQW-UHFFFAOYSA-N |
Molecular Formula | C22H24N2O10 |
Trifluoroacetic acid, silver salt, 98%
CAS: 2966-50-9 Molecular Formula: C2AgF3O2 Molecular Weight (g/mol): 220.89 MDL Number: MFCD00013199 InChI Key: KZJPVUDYAMEDRM-UHFFFAOYSA-M Synonym: silver trifluoroacetate,silver 1+ trifluoroacetate,silver i 2,2,2-trifluoroacetate,silver mono trifluoroacetate,trifluoroacetic acid silver salt,silver 1+ ion trifluoroacetate,acetic acid, trifluoro-, silver 1+ salt,silver i trifluoroacetate,trifluoroacetic acid, silver salt,trifluoroacetic acid, silver 1+ salt PubChem CID: 76299 IUPAC Name: silver;2,2,2-trifluoroacetate SMILES: C(=O)(C(F)(F)F)[O-].[Ag+]

PubChem CID | 76299 |
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CAS | 2966-50-9 |
Molecular Weight (g/mol) | 220.89 |
MDL Number | MFCD00013199 |
SMILES | C(=O)(C(F)(F)F)[O-].[Ag+] |
Synonym | silver trifluoroacetate,silver 1+ trifluoroacetate,silver i 2,2,2-trifluoroacetate,silver mono trifluoroacetate,trifluoroacetic acid silver salt,silver 1+ ion trifluoroacetate,acetic acid, trifluoro-, silver 1+ salt,silver i trifluoroacetate,trifluoroacetic acid, silver salt,trifluoroacetic acid, silver 1+ salt |
IUPAC Name | silver;2,2,2-trifluoroacetate |
InChI Key | KZJPVUDYAMEDRM-UHFFFAOYSA-M |
Molecular Formula | C2AgF3O2 |
(-)-Diethyl D-tartrate, 99%, made from unnatural tartaric acid
CAS: 13811-71-7 Molecular Formula: C8H14O6 Molecular Weight (g/mol): 206.19 MDL Number: MFCD00064451 InChI Key: YSAVZVORKRDODB-WDSKDSINSA-N Synonym: --diethyl d-tartrate,2s,3s-diethyl 2,3-dihydroxysuccinate,diethyl d-tartrate,d---tartaric acid diethyl ester,diethyl d---tartrate,diethyl-d-tartrate,diethyl 2s,3s-2,3-dihydroxybutanedioate,2s,3s--dihydroxybutane-1,4-dioic acid diethyl ester,--diethyl-d-tartrate,diethyl s-r*,r*-tartrate PubChem CID: 117410 IUPAC Name: diethyl (2S,3S)-2,3-dihydroxybutanedioate SMILES: CCOC(=O)[C@@H](O)[C@H](O)C(=O)OCC

PubChem CID | 117410 |
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CAS | 13811-71-7 |
Molecular Weight (g/mol) | 206.19 |
MDL Number | MFCD00064451 |
SMILES | CCOC(=O)[C@@H](O)[C@H](O)C(=O)OCC |
Synonym | --diethyl d-tartrate,2s,3s-diethyl 2,3-dihydroxysuccinate,diethyl d-tartrate,d---tartaric acid diethyl ester,diethyl d---tartrate,diethyl-d-tartrate,diethyl 2s,3s-2,3-dihydroxybutanedioate,2s,3s--dihydroxybutane-1,4-dioic acid diethyl ester,--diethyl-d-tartrate,diethyl s-r*,r*-tartrate |
IUPAC Name | diethyl (2S,3S)-2,3-dihydroxybutanedioate |
InChI Key | YSAVZVORKRDODB-WDSKDSINSA-N |
Molecular Formula | C8H14O6 |