
Organic acids and derivatives























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2-Naphthaleneboronic acid, 97+%
CAS: 32316-92-0 Molecular Formula: C10H9BO2 Molecular Weight (g/mol): 171.99 MDL Number: MFCD00236051 InChI Key: KPTRDYONBVUWPD-UHFFFAOYSA-N Synonym: 2-naphthaleneboronic acid,2-naphthylboronic acid,naphthalene-2-boronic acid,2-naphthalene boronic acid,2-naphthaleneylboronic acid,naphthalenyl-2-boronic acid,2-naphtahaleneboronic acid,beta-naphthylboronic acid,naphthalen-2-boronic acid,naphthalen-2-yl-boranediol PubChem CID: 2734375 IUPAC Name: naphthalen-2-ylboronic acid SMILES: OB(O)C1=CC2=CC=CC=C2C=C1

PubChem CID | 2734375 |
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CAS | 32316-92-0 |
Molecular Weight (g/mol) | 171.99 |
MDL Number | MFCD00236051 |
SMILES | OB(O)C1=CC2=CC=CC=C2C=C1 |
Synonym | 2-naphthaleneboronic acid,2-naphthylboronic acid,naphthalene-2-boronic acid,2-naphthalene boronic acid,2-naphthaleneylboronic acid,naphthalenyl-2-boronic acid,2-naphtahaleneboronic acid,beta-naphthylboronic acid,naphthalen-2-boronic acid,naphthalen-2-yl-boranediol |
IUPAC Name | naphthalen-2-ylboronic acid |
InChI Key | KPTRDYONBVUWPD-UHFFFAOYSA-N |
Molecular Formula | C10H9BO2 |
Citric acid, trisodium salt, 98%, pure, anhydrous
CAS: 68-04-2 Molecular Formula: C6H5Na3O7 Molecular Weight (g/mol): 258.07 MDL Number: MFCD00012462 InChI Key: HRXKRNGNAMMEHJ-UHFFFAOYSA-K Synonym: sodium citrate,trisodium citrate,citrosodine,sodium citrate anhydrous,citrosodina,natrocitral,citnatin,citreme,citrosodna,trisodium citrate, anhydrous PubChem CID: 6224 ChEBI: CHEBI:53258 IUPAC Name: trisodium;2-hydroxypropane-1,2,3-tricarboxylate SMILES: [Na+].[Na+].[Na+].OC(CC([O-])=O)(CC([O-])=O)C([O-])=O

PubChem CID | 6224 |
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CAS | 68-04-2 |
Molecular Weight (g/mol) | 258.07 |
ChEBI | CHEBI:53258 |
MDL Number | MFCD00012462 |
SMILES | [Na+].[Na+].[Na+].OC(CC([O-])=O)(CC([O-])=O)C([O-])=O |
Synonym | sodium citrate,trisodium citrate,citrosodine,sodium citrate anhydrous,citrosodina,natrocitral,citnatin,citreme,citrosodna,trisodium citrate, anhydrous |
IUPAC Name | trisodium;2-hydroxypropane-1,2,3-tricarboxylate |
InChI Key | HRXKRNGNAMMEHJ-UHFFFAOYSA-K |
Molecular Formula | C6H5Na3O7 |
3-Hydroxyphthalic anhydride, 97%
CAS: 37418-88-5 Molecular Formula: C8H4O4 Molecular Weight (g/mol): 164.12 MDL Number: MFCD00011557 InChI Key: CCTOEAMRIIXGDJ-UHFFFAOYSA-N Synonym: 3-hydroxyphthalic anhydride,4-hydroxyisobenzofuran-1,3-dione,3-hydroxyphthalic acid anhydride,1,3-isobenzofurandione, 4-hydroxy,4-hydroxy-isobenzofuran-1,3-dione,phthalic anhydride, 3-hydroxy,4-hydroxy-1,3-dihydro-2-benzofuran-1,3-dione,1,3-isobenzofurandione,4-hydroxy,3-hydroxyphthalicanhydride,3-hydroxyphthalic anhydride treated .beta.-lactoglobulin from bovine whey PubChem CID: 96580 IUPAC Name: 4-hydroxy-2-benzofuran-1,3-dione SMILES: C1=CC2=C(C(=C1)O)C(=O)OC2=O

PubChem CID | 96580 |
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CAS | 37418-88-5 |
Molecular Weight (g/mol) | 164.12 |
MDL Number | MFCD00011557 |
SMILES | C1=CC2=C(C(=C1)O)C(=O)OC2=O |
Synonym | 3-hydroxyphthalic anhydride,4-hydroxyisobenzofuran-1,3-dione,3-hydroxyphthalic acid anhydride,1,3-isobenzofurandione, 4-hydroxy,4-hydroxy-isobenzofuran-1,3-dione,phthalic anhydride, 3-hydroxy,4-hydroxy-1,3-dihydro-2-benzofuran-1,3-dione,1,3-isobenzofurandione,4-hydroxy,3-hydroxyphthalicanhydride,3-hydroxyphthalic anhydride treated .beta.-lactoglobulin from bovine whey |
IUPAC Name | 4-hydroxy-2-benzofuran-1,3-dione |
InChI Key | CCTOEAMRIIXGDJ-UHFFFAOYSA-N |
Molecular Formula | C8H4O4 |
1-Acetyl-3-indolecarboxaldehyde, 98%, Thermo Scientific™
CAS: 22948-94-3 Molecular Formula: C11H9NO2 Molecular Weight (g/mol): 187.2 MDL Number: MFCD00039691 InChI Key: LCJLFGSKHBDOAY-UHFFFAOYSA-N Synonym: 1-acetyl-1h-indole-3-carbaldehyde,n-acetylindole-3-carboxaldehyde,1-acetylindole-3-carboxaldehyde,1-acetyl-3-indolecarboxaldehyde,1h-indole-3-carboxaldehyde, 1-acetyl,1-acetyl-3-formylindole,zlchem 389,pubchem7227,n-acetylindole-3-aldehyde,acmc-1crl1 PubChem CID: 89915 IUPAC Name: 1-acetylindole-3-carbaldehyde SMILES: CC(=O)N1C=C(C2=CC=CC=C21)C=O

PubChem CID | 89915 |
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CAS | 22948-94-3 |
Molecular Weight (g/mol) | 187.2 |
MDL Number | MFCD00039691 |
SMILES | CC(=O)N1C=C(C2=CC=CC=C21)C=O |
Synonym | 1-acetyl-1h-indole-3-carbaldehyde,n-acetylindole-3-carboxaldehyde,1-acetylindole-3-carboxaldehyde,1-acetyl-3-indolecarboxaldehyde,1h-indole-3-carboxaldehyde, 1-acetyl,1-acetyl-3-formylindole,zlchem 389,pubchem7227,n-acetylindole-3-aldehyde,acmc-1crl1 |
IUPAC Name | 1-acetylindole-3-carbaldehyde |
InChI Key | LCJLFGSKHBDOAY-UHFFFAOYSA-N |
Molecular Formula | C11H9NO2 |
3-Carboxyphenylboronic acid, 97%
CAS: 25487665 Molecular Formula: C7H7BO4 Molecular Weight (g/mol): 165.94 MDL Number: MFCD00036833 InChI Key: DBVFWZMQJQMJCB-UHFFFAOYSA-N Synonym: 3-carboxyphenylboronic acid,3-dihydroxyboranyl benzoic acid,3-carboxybenzeneboronic acid,m-carboxyphenylboronic acid,3-dihydroxyborane benzoic acid,benzoic acid, 3-borono,3-dihydroxyboryl benzoic acid,3-phenyl ester boronic acid,3-carboxyphenyl boronic acid,3-carboxy-phenyl-boronic acid PubChem CID: 2733957 IUPAC Name: 3-boronobenzoic acid SMILES: OB(O)C1=CC=CC(=C1)C(O)=O

PubChem CID | 2733957 |
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CAS | 25487665 |
Molecular Weight (g/mol) | 165.94 |
MDL Number | MFCD00036833 |
SMILES | OB(O)C1=CC=CC(=C1)C(O)=O |
Synonym | 3-carboxyphenylboronic acid,3-dihydroxyboranyl benzoic acid,3-carboxybenzeneboronic acid,m-carboxyphenylboronic acid,3-dihydroxyborane benzoic acid,benzoic acid, 3-borono,3-dihydroxyboryl benzoic acid,3-phenyl ester boronic acid,3-carboxyphenyl boronic acid,3-carboxy-phenyl-boronic acid |
IUPAC Name | 3-boronobenzoic acid |
InChI Key | DBVFWZMQJQMJCB-UHFFFAOYSA-N |
Molecular Formula | C7H7BO4 |
(-)-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 |
3-Nitrobenzenesulfonic acid, sodium salt, 97%
CAS: 127-68-4 Molecular Formula: C6H4NNaO5S Molecular Weight (g/mol): 225.15 MDL Number: MFCD00007490 InChI Key: LJRGBERXYNQPJI-UHFFFAOYSA-M Synonym: sodium 3-nitrobenzenesulfonate,3-nitrobenzenesulfonic acid sodium salt,sodium 3-nitrobenzenesulphonate,sodium m-nitrobenzenesulfonate,nitrol s,tiskan czech,ludigol,ludigol f,60,benzenesulfonic acid, 3-nitro-, sodium salt,unii-1f11sxj4c6 PubChem CID: 31389 IUPAC Name: sodium;3-nitrobenzenesulfonate SMILES: C1=CC(=CC(=C1)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]

PubChem CID | 31389 |
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CAS | 127-68-4 |
Molecular Weight (g/mol) | 225.15 |
MDL Number | MFCD00007490 |
SMILES | C1=CC(=CC(=C1)S(=O)(=O)[O-])[N+](=O)[O-].[Na+] |
Synonym | sodium 3-nitrobenzenesulfonate,3-nitrobenzenesulfonic acid sodium salt,sodium 3-nitrobenzenesulphonate,sodium m-nitrobenzenesulfonate,nitrol s,tiskan czech,ludigol,ludigol f,60,benzenesulfonic acid, 3-nitro-, sodium salt,unii-1f11sxj4c6 |
IUPAC Name | sodium;3-nitrobenzenesulfonate |
InChI Key | LJRGBERXYNQPJI-UHFFFAOYSA-M |
Molecular Formula | C6H4NNaO5S |
Pyrazolo[1,5-a]pyrimidine-2-carboxylic acid, 97%, Thermo Scientific™
CAS: 378211-85-9 Molecular Formula: C7H5N3O2 Molecular Weight (g/mol): 163.14 MDL Number: MFCD00297221 InChI Key: DZPAOAZDQHZRGG-UHFFFAOYSA-N Synonym: pyrazolo 1,5-a pyrimidine-2-carboxylic acid,8-hydropyrazolo 1,5-a pyrimidine-2-carboxylic acid,2-pyrazolo 1,5-a pyrimidinecarboxylic acid,pyrazolo 1,5-a pyrimidine-2-carboxylicacid,acmc-1afu0,pyrazolo 1,5-a pyrimidinecarboxylic acid,pyrazolo 1?5-a pyrimidine-2-carboxylic acid,pyrazolo 1,5-a pyrimidine-2-carboxylic acid 9ci,2-methyl-3-2-trimethylsilyl ethoxy methyl-3h-imidazo 4,5-b pyridin-6-yl boronic acid PubChem CID: 670824 IUPAC Name: pyrazolo[1,5-a]pyrimidine-2-carboxylic acid SMILES: C1=CN2C(=CC(=N2)C(=O)O)N=C1

PubChem CID | 670824 |
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CAS | 378211-85-9 |
Molecular Weight (g/mol) | 163.14 |
MDL Number | MFCD00297221 |
SMILES | C1=CN2C(=CC(=N2)C(=O)O)N=C1 |
Synonym | pyrazolo 1,5-a pyrimidine-2-carboxylic acid,8-hydropyrazolo 1,5-a pyrimidine-2-carboxylic acid,2-pyrazolo 1,5-a pyrimidinecarboxylic acid,pyrazolo 1,5-a pyrimidine-2-carboxylicacid,acmc-1afu0,pyrazolo 1,5-a pyrimidinecarboxylic acid,pyrazolo 1?5-a pyrimidine-2-carboxylic acid,pyrazolo 1,5-a pyrimidine-2-carboxylic acid 9ci,2-methyl-3-2-trimethylsilyl ethoxy methyl-3h-imidazo 4,5-b pyridin-6-yl boronic acid |
IUPAC Name | pyrazolo[1,5-a]pyrimidine-2-carboxylic acid |
InChI Key | DZPAOAZDQHZRGG-UHFFFAOYSA-N |
Molecular Formula | C7H5N3O2 |
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 |
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 |
Dibenzyl phosphate, 98%
CAS: 1623-08-1 Molecular Formula: C14H15O4P Molecular Weight (g/mol): 278.23 MDL Number: MFCD00004775 InChI Key: HDFFVHSMHLDSLO-UHFFFAOYSA-N Synonym: dibenzyl phosphate,phosphoric acid dibenzyl ester,dibenzylphosphoric acid,unii-y65r35lz0s,phosphoric acid, bis phenylmethyl ester,dibenzylphosphate,creatine phosphate disodium impurity 4,dibenzyloxyphosphinic acid,dibenzyl-phosphate,pubchem14883 PubChem CID: 74189 IUPAC Name: dibenzyl hydrogen phosphate SMILES: C1=CC=C(C=C1)COP(=O)(O)OCC2=CC=CC=C2

PubChem CID | 74189 |
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CAS | 1623-08-1 |
Molecular Weight (g/mol) | 278.23 |
MDL Number | MFCD00004775 |
SMILES | C1=CC=C(C=C1)COP(=O)(O)OCC2=CC=CC=C2 |
Synonym | dibenzyl phosphate,phosphoric acid dibenzyl ester,dibenzylphosphoric acid,unii-y65r35lz0s,phosphoric acid, bis phenylmethyl ester,dibenzylphosphate,creatine phosphate disodium impurity 4,dibenzyloxyphosphinic acid,dibenzyl-phosphate,pubchem14883 |
IUPAC Name | dibenzyl hydrogen phosphate |
InChI Key | HDFFVHSMHLDSLO-UHFFFAOYSA-N |
Molecular Formula | C14H15O4P |
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 |
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 |