Organic acids and derivatives
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Methyl methoxyacetate, 99%
CAS: 6290-49-9 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00008451 InChI Key: QRMHDGWGLNLHMN-UHFFFAOYSA-N Synonym: methyl methoxyacetate,acetic acid, methoxy-, methyl ester,methoxyacetic acid methyl ester,methyl-2-methoxyacetate,methoxyacetic acid, methyl ester,acetic acid, 2-methoxy-, methyl ester,unii-n960nq69lf,methoxy acetic acid methyl ester,methyl metoxyacetate,methyl methoxylacetate PubChem CID: 80507 ChEBI: CHEBI:34841 IUPAC Name: methyl 2-methoxyacetate SMILES: COCC(=O)OC
| PubChem CID | 80507 |
|---|---|
| CAS | 6290-49-9 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:34841 |
| MDL Number | MFCD00008451 |
| SMILES | COCC(=O)OC |
| Synonym | methyl methoxyacetate,acetic acid, methoxy-, methyl ester,methoxyacetic acid methyl ester,methyl-2-methoxyacetate,methoxyacetic acid, methyl ester,acetic acid, 2-methoxy-, methyl ester,unii-n960nq69lf,methoxy acetic acid methyl ester,methyl metoxyacetate,methyl methoxylacetate |
| IUPAC Name | methyl 2-methoxyacetate |
| InChI Key | QRMHDGWGLNLHMN-UHFFFAOYSA-N |
| Molecular Formula | C4H8O3 |
4-Pyrazolecarboxylic acid, 97%
CAS: 37718-11-9 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.09 MDL Number: MFCD00011558 InChI Key: IMBBXSASDSZJSX-UHFFFAOYSA-N Synonym: 4-pyrazolecarboxylic acid,4-carboxypyrazole,pyrazole-4-carboxylic acid,unii-4xjz84gv8e,1h-pyrazole-4-carboxylicacid,4-carboxy-1h-pyrazole,4xjz84gv8e,pyrazole-4-carboxylic,pubchem13293,pubchem22749 PubChem CID: 3015937 IUPAC Name: 1H-pyrazole-4-carboxylic acid SMILES: C1=C(C=NN1)C(=O)O
| PubChem CID | 3015937 |
|---|---|
| CAS | 37718-11-9 |
| Molecular Weight (g/mol) | 112.09 |
| MDL Number | MFCD00011558 |
| SMILES | C1=C(C=NN1)C(=O)O |
| Synonym | 4-pyrazolecarboxylic acid,4-carboxypyrazole,pyrazole-4-carboxylic acid,unii-4xjz84gv8e,1h-pyrazole-4-carboxylicacid,4-carboxy-1h-pyrazole,4xjz84gv8e,pyrazole-4-carboxylic,pubchem13293,pubchem22749 |
| IUPAC Name | 1H-pyrazole-4-carboxylic acid |
| InChI Key | IMBBXSASDSZJSX-UHFFFAOYSA-N |
| Molecular Formula | C4H4N2O2 |
Thermo Scientific Chemicals Barium diphenylaminesulfonate, pure, indicator grade
CAS: 6211-24-1 Molecular Formula: C24H20BaN2O6S2 Molecular Weight (g/mol): 633.88 MDL Number: MFCD00007497 InChI Key: IVCNVXFNTKXMCA-UHFFFAOYSA-L Synonym: barium diphenylamine-4-sulfonate,barium diphenylaminesulfonate,benzenesulfonic acid, 4-phenylamino-, barium salt 2:1,barium bis 4-anilinobenzenesulphonate,barium diphenylamine sulfonate,n-phenylsufanilic acid barium,unii-ssj5f79159,diphenylamine-4-sulfonic acid barium salt,n-phenylsufanilic acid, barium salt,4-anilinobenzenesulfonate; barium 2+ PubChem CID: 80342 IUPAC Name: 4-anilinobenzenesulfonate;barium(2+) SMILES: [Ba++].[O-]S(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1.[O-]S(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1
| PubChem CID | 80342 |
|---|---|
| CAS | 6211-24-1 |
| Molecular Weight (g/mol) | 633.88 |
| MDL Number | MFCD00007497 |
| SMILES | [Ba++].[O-]S(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1.[O-]S(=O)(=O)C1=CC=C(NC2=CC=CC=C2)C=C1 |
| Synonym | barium diphenylamine-4-sulfonate,barium diphenylaminesulfonate,benzenesulfonic acid, 4-phenylamino-, barium salt 2:1,barium bis 4-anilinobenzenesulphonate,barium diphenylamine sulfonate,n-phenylsufanilic acid barium,unii-ssj5f79159,diphenylamine-4-sulfonic acid barium salt,n-phenylsufanilic acid, barium salt,4-anilinobenzenesulfonate; barium 2+ |
| IUPAC Name | 4-anilinobenzenesulfonate;barium(2+) |
| InChI Key | IVCNVXFNTKXMCA-UHFFFAOYSA-L |
| Molecular Formula | C24H20BaN2O6S2 |
N-(3-Bromopropyl)phthalimide, 98%
CAS: 5460-29-7 Molecular Formula: C11H10BrNO2 Molecular Weight (g/mol): 268.1 MDL Number: MFCD00005904 InChI Key: VKJCJJYNVIYVQR-UHFFFAOYSA-N Synonym: n-3-bromopropyl phthalimide,2-3-bromopropyl isoindoline-1,3-dione,1-phthalimido-3-bromopropane,3-bromopropylphthalimide,n-3-bromopropylphthalimide,gamma-bromopropylphthalimide,2-3-bromopropyl-1h-isoindole-1,3 2h-dione,2-3-bromopropyl-2,3-dihydro-1h-isoindole-1,3-dione,phthalimide, n-3-bromopropyl,1h-isoindole-1,3 2h-dione, 2-3-bromopropyl PubChem CID: 21611 IUPAC Name: 2-(3-bromopropyl)isoindole-1,3-dione SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CCCBr
| PubChem CID | 21611 |
|---|---|
| CAS | 5460-29-7 |
| Molecular Weight (g/mol) | 268.1 |
| MDL Number | MFCD00005904 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCCBr |
| Synonym | n-3-bromopropyl phthalimide,2-3-bromopropyl isoindoline-1,3-dione,1-phthalimido-3-bromopropane,3-bromopropylphthalimide,n-3-bromopropylphthalimide,gamma-bromopropylphthalimide,2-3-bromopropyl-1h-isoindole-1,3 2h-dione,2-3-bromopropyl-2,3-dihydro-1h-isoindole-1,3-dione,phthalimide, n-3-bromopropyl,1h-isoindole-1,3 2h-dione, 2-3-bromopropyl |
| IUPAC Name | 2-(3-bromopropyl)isoindole-1,3-dione |
| InChI Key | VKJCJJYNVIYVQR-UHFFFAOYSA-N |
| Molecular Formula | C11H10BrNO2 |
5-Indolylboronic acid, 97%
CAS: 144104-59-6 Molecular Formula: C8H8BNO2 Molecular Weight (g/mol): 160.97 MDL Number: MFCD01319013 InChI Key: VHADYSUJZAPXOW-UHFFFAOYSA-N Synonym: 5-indolylboronic acid,indole-5-boronic acid,1h-indol-5-yl boronic acid,1h-indole-5-boronic acid,5-indolboronic acid,5-indolyl boronic acid,5-indole-boronic acid,1h-indol-5-ylboranediol,5-indole boric acid,5-indoleboronic acid PubChem CID: 2734361 IUPAC Name: 1H-indol-5-ylboronic acid SMILES: OB(O)C1=CC=C2NC=CC2=C1
| PubChem CID | 2734361 |
|---|---|
| CAS | 144104-59-6 |
| Molecular Weight (g/mol) | 160.97 |
| MDL Number | MFCD01319013 |
| SMILES | OB(O)C1=CC=C2NC=CC2=C1 |
| Synonym | 5-indolylboronic acid,indole-5-boronic acid,1h-indol-5-yl boronic acid,1h-indole-5-boronic acid,5-indolboronic acid,5-indolyl boronic acid,5-indole-boronic acid,1h-indol-5-ylboranediol,5-indole boric acid,5-indoleboronic acid |
| IUPAC Name | 1H-indol-5-ylboronic acid |
| InChI Key | VHADYSUJZAPXOW-UHFFFAOYSA-N |
| Molecular Formula | C8H8BNO2 |
Sodium succinate hexahydrate, 99%
CAS: 6106-21-4 Molecular Formula: C4H16Na2O10 Molecular Weight (g/mol): 270.142 MDL Number: MFCD00149117 InChI Key: ZBTUYCUNQBRXOR-UHFFFAOYSA-L Synonym: disodium succinate hexahydrate,sodium succinate hexahydrate,unii-u16qod6c4e,butanedioic acid, disodium salt, hexahydrate,disodium butanedioate hexahydrate,u16qod6c4e,disodium hexahydrate succinate,sodium succinate dibasic hexahydrate,butanedioic acid disodium salt,succinic acid disodium salt hexahydrate PubChem CID: 3083938 ChEBI: CHEBI:63686 IUPAC Name: disodium;butanedioate;hexahydrate SMILES: C(CC(=O)[O-])C(=O)[O-].O.O.O.O.O.O.[Na+].[Na+]
| PubChem CID | 3083938 |
|---|---|
| CAS | 6106-21-4 |
| Molecular Weight (g/mol) | 270.142 |
| ChEBI | CHEBI:63686 |
| MDL Number | MFCD00149117 |
| SMILES | C(CC(=O)[O-])C(=O)[O-].O.O.O.O.O.O.[Na+].[Na+] |
| Synonym | disodium succinate hexahydrate,sodium succinate hexahydrate,unii-u16qod6c4e,butanedioic acid, disodium salt, hexahydrate,disodium butanedioate hexahydrate,u16qod6c4e,disodium hexahydrate succinate,sodium succinate dibasic hexahydrate,butanedioic acid disodium salt,succinic acid disodium salt hexahydrate |
| IUPAC Name | disodium;butanedioate;hexahydrate |
| InChI Key | ZBTUYCUNQBRXOR-UHFFFAOYSA-L |
| Molecular Formula | C4H16Na2O10 |
Edetate Disodium, U.S.P., J.T. Baker™
CAS: 6381-92-6 Molecular Formula: C10H18N2Na2O10 Molecular Weight (g/mol): 372.24 MDL Number: MFCD00150037,MFCD00003541 InChI Key: OVBJJZOQPCKUOR-UHFFFAOYSA-L Synonym: edta disodium salt,cal-ex decalcifier,buffer solution, ph 10.00,sodium di ethylenediamine tetraacetate dihydrate,ethylenediamine tetraacetic acid, disodium salt dihydrate,ethylenediamine tetraacetic acid, disodium salt, standard solution,sodium di ethylenediamine tetraacetate standard solution,ethylenedinitrilo tetraacetic acid disodium, dihydrate, reagent, acs PubChem CID: 44120005 IUPAC Name: disodium;2-[2-[bis(carboxymethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;dihydrate SMILES: O.O.[Na+].[Na+].OC(=O)CN(CCN(CC(O)=O)CC([O-])=O)CC([O-])=O
| PubChem CID | 44120005 |
|---|---|
| CAS | 6381-92-6 |
| Molecular Weight (g/mol) | 372.24 |
| MDL Number | MFCD00150037,MFCD00003541 |
| SMILES | O.O.[Na+].[Na+].OC(=O)CN(CCN(CC(O)=O)CC([O-])=O)CC([O-])=O |
| Synonym | edta disodium salt,cal-ex decalcifier,buffer solution, ph 10.00,sodium di ethylenediamine tetraacetate dihydrate,ethylenediamine tetraacetic acid, disodium salt dihydrate,ethylenediamine tetraacetic acid, disodium salt, standard solution,sodium di ethylenediamine tetraacetate standard solution,ethylenedinitrilo tetraacetic acid disodium, dihydrate, reagent, acs |
| IUPAC Name | disodium;2-[2-[bis(carboxymethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;dihydrate |
| InChI Key | OVBJJZOQPCKUOR-UHFFFAOYSA-L |
| Molecular Formula | C10H18N2Na2O10 |
Ammonium acetate, 97%
CAS: 631-61-8 Molecular Formula: C2H7NO2 Molecular Weight (g/mol): 77.083 MDL Number: MFCD00013066 InChI Key: USFZMSVCRYTOJT-UHFFFAOYSA-N Synonym: ammonium acetate,acetic acid, ammonium salt,azanium acetate,ammoniumacetate,acetic acid ammonium salt,ammonium ethanoate,unii-rre756s6q2,aconh4,ch3coonh4,ch3co2nh4 PubChem CID: 517165 ChEBI: CHEBI:62947 IUPAC Name: azanium;acetate SMILES: CC(=O)[O-].[NH4+]
| PubChem CID | 517165 |
|---|---|
| CAS | 631-61-8 |
| Molecular Weight (g/mol) | 77.083 |
| ChEBI | CHEBI:62947 |
| MDL Number | MFCD00013066 |
| SMILES | CC(=O)[O-].[NH4+] |
| Synonym | ammonium acetate,acetic acid, ammonium salt,azanium acetate,ammoniumacetate,acetic acid ammonium salt,ammonium ethanoate,unii-rre756s6q2,aconh4,ch3coonh4,ch3co2nh4 |
| IUPAC Name | azanium;acetate |
| InChI Key | USFZMSVCRYTOJT-UHFFFAOYSA-N |
| Molecular Formula | C2H7NO2 |
L-Ascorbic acid sodium salt, 99%
CAS: 134-03-2 Molecular Formula: C6H7NaO6 Molecular Weight (g/mol): 198.11 MDL Number: MFCD00082340 InChI Key: IFVCRSPJFHGFCG-HXPAKLQESA-N Synonym: sodium ascorbate,l-ascorbic acid sodium salt,sodium l-ascorbate,vitamin c sodium,ascorbicin,sodascorbate,cebitate,aminofenitrooxon,natrii ascorbas,monosodium l-ascorbate PubChem CID: 131674100 IUPAC Name: sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide SMILES: [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O
| PubChem CID | 131674100 |
|---|---|
| CAS | 134-03-2 |
| Molecular Weight (g/mol) | 198.11 |
| MDL Number | MFCD00082340 |
| SMILES | [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O |
| Synonym | sodium ascorbate,l-ascorbic acid sodium salt,sodium l-ascorbate,vitamin c sodium,ascorbicin,sodascorbate,cebitate,aminofenitrooxon,natrii ascorbas,monosodium l-ascorbate |
| IUPAC Name | sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide |
| InChI Key | IFVCRSPJFHGFCG-HXPAKLQESA-N |
| Molecular Formula | C6H7NaO6 |
Trisodium citrate dihydrate, 99%
CAS: 4-3-6132 Molecular Formula: C6H9Na3O9 Molecular Weight (g/mol): 294.10 MDL Number: MFCD00150031 InChI Key: NLJMYIDDQXHKNR-UHFFFAOYSA-K Synonym: trisodium citrate dihydrate,sodium citrate dihydrate,sodium citrate tribasic dihydrate,natriumcitrat-dihydrat,sodium citrate hydrate,1,2,3-propanetricarboxylic acid, 2-hydroxy-, trisodium salt, dihydrate,citronensaeure-tri-na-salz-dihydrat,citric acid trisodium salt dihydrate,citric acid, trisodium salt dihydrate,trisodium 2-hydroxypropane-1,2,3-tricarboxylate dihydrate PubChem CID: 71474 ChEBI: CHEBI:32142 IUPAC Name: trisodium;2-hydroxypropane-1,2,3-tricarboxylate;dihydrate SMILES: C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.[Na+].[Na+].[Na+]
| PubChem CID | 71474 |
|---|---|
| CAS | 4-3-6132 |
| Molecular Weight (g/mol) | 294.10 |
| ChEBI | CHEBI:32142 |
| MDL Number | MFCD00150031 |
| SMILES | C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.[Na+].[Na+].[Na+] |
| Synonym | trisodium citrate dihydrate,sodium citrate dihydrate,sodium citrate tribasic dihydrate,natriumcitrat-dihydrat,sodium citrate hydrate,1,2,3-propanetricarboxylic acid, 2-hydroxy-, trisodium salt, dihydrate,citronensaeure-tri-na-salz-dihydrat,citric acid trisodium salt dihydrate,citric acid, trisodium salt dihydrate,trisodium 2-hydroxypropane-1,2,3-tricarboxylate dihydrate |
| IUPAC Name | trisodium;2-hydroxypropane-1,2,3-tricarboxylate;dihydrate |
| InChI Key | NLJMYIDDQXHKNR-UHFFFAOYSA-K |
| Molecular Formula | C6H9Na3O9 |
Methyl 6-chloropyridazine-4-carboxylate, 97%
CAS: 1093860-48-0 Molecular Formula: C6H5ClN2O2 Molecular Weight (g/mol): 172.57 MDL Number: MFCD16660968 InChI Key: QYQHGLKSLGUINZ-UHFFFAOYSA-N Synonym: 6-chloro-pyridazine-4-carboxylic acid methyl ester,methyl6-chloropyridazine-4-carboxylate,4-pyridazinecarboxylicacid, 6-chloro-, methyl ester,6-chloro-4-pyridazinecarboxylic acid, methyl ester,4-pyridazinecarboxylic acid, 6-chloro-, methyl ester PubChem CID: 45790080 IUPAC Name: methyl 6-chloropyridazine-4-carboxylate SMILES: COC(=O)C1=CC(Cl)=NN=C1
| PubChem CID | 45790080 |
|---|---|
| CAS | 1093860-48-0 |
| Molecular Weight (g/mol) | 172.57 |
| MDL Number | MFCD16660968 |
| SMILES | COC(=O)C1=CC(Cl)=NN=C1 |
| Synonym | 6-chloro-pyridazine-4-carboxylic acid methyl ester,methyl6-chloropyridazine-4-carboxylate,4-pyridazinecarboxylicacid, 6-chloro-, methyl ester,6-chloro-4-pyridazinecarboxylic acid, methyl ester,4-pyridazinecarboxylic acid, 6-chloro-, methyl ester |
| IUPAC Name | methyl 6-chloropyridazine-4-carboxylate |
| InChI Key | QYQHGLKSLGUINZ-UHFFFAOYSA-N |
| Molecular Formula | C6H5ClN2O2 |
LiChropur™ Ammonium formate, Eluent additive for LC-MS, ≥99.0%, MilliporeSigma™ Supelco™
MDL Number: MFCD00013103 Synonym: Formic acid ammonium salt
| MDL Number | MFCD00013103 |
|---|---|
| Synonym | Formic acid ammonium salt |
Methyl cyanoacetate, 97%
CAS: 105-34-0 Molecular Formula: C4H5NO2 Molecular Weight (g/mol): 99.09 MDL Number: MFCD00001939 InChI Key: ANGDWNBGPBMQHW-UHFFFAOYSA-N Synonym: methyl cyanoacetate,cyanoacetic acid methyl ester,methyl cyanoethanoate,acetic acid, cyano-, methyl ester,usaf kf-22,methylester kyseliny kyanoctove,methylcyanoacetate,malonic methyl ester nitrile,acetic acid, 2-cyano-, methyl ester,methyl cyano acetate PubChem CID: 7747 ChEBI: CHEBI:51928 IUPAC Name: methyl 2-cyanoacetate SMILES: COC(=O)CC#N
| PubChem CID | 7747 |
|---|---|
| CAS | 105-34-0 |
| Molecular Weight (g/mol) | 99.09 |
| ChEBI | CHEBI:51928 |
| MDL Number | MFCD00001939 |
| SMILES | COC(=O)CC#N |
| Synonym | methyl cyanoacetate,cyanoacetic acid methyl ester,methyl cyanoethanoate,acetic acid, cyano-, methyl ester,usaf kf-22,methylester kyseliny kyanoctove,methylcyanoacetate,malonic methyl ester nitrile,acetic acid, 2-cyano-, methyl ester,methyl cyano acetate |
| IUPAC Name | methyl 2-cyanoacetate |
| InChI Key | ANGDWNBGPBMQHW-UHFFFAOYSA-N |
| Molecular Formula | C4H5NO2 |
Ethylenediaminetetraacetic acid, 99%
CAS: 60-00-4 Molecular Formula: C10H16N2O8 Molecular Weight (g/mol): 292.24 MDL Number: MFCD00003541 InChI Key: KCXVZYZYPLLWCC-UHFFFAOYSA-N Synonym: edta,edetic acid,ethylenediaminetetraacetic acid,edathamil,versene,endrate,havidote,titriplex,edta acid,sequestrol PubChem CID: 6049 ChEBI: CHEBI:42191 IUPAC Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid SMILES: OC(=O)CN(CCN(CC(O)=O)CC(O)=O)CC(O)=O
| PubChem CID | 6049 |
|---|---|
| CAS | 60-00-4 |
| Molecular Weight (g/mol) | 292.24 |
| ChEBI | CHEBI:42191 |
| MDL Number | MFCD00003541 |
| SMILES | OC(=O)CN(CCN(CC(O)=O)CC(O)=O)CC(O)=O |
| Synonym | edta,edetic acid,ethylenediaminetetraacetic acid,edathamil,versene,endrate,havidote,titriplex,edta acid,sequestrol |
| IUPAC Name | 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid |
| InChI Key | KCXVZYZYPLLWCC-UHFFFAOYSA-N |
| Molecular Formula | C10H16N2O8 |
N-(4-Pentynyl)phthalimide, 97%
CAS: 6097-07-0 Molecular Formula: C13H11NO2 Molecular Weight (g/mol): 213.23 MDL Number: MFCD06798110 InChI Key: YNZIPXLLPFYDGM-UHFFFAOYSA-N Synonym: n-4-pentynyl phthalimide,2-pent-4-ynyl isoindoline-1,3-dione,1-phthalimido-4-pentyne,2-pent-4-yn-1-yl isoindoline-1,3-dione,n-4-pentynyl phthalimide 97,2-pent-4-yn-1-yl isoindole-1,3-dione,5-phthalimido-1-pentyne,2-pent-4-ynyl-isoindole-1,3-dione PubChem CID: 11769822 IUPAC Name: 2-pent-4-ynylisoindole-1,3-dione SMILES: C#CCCCN1C(=O)C2=CC=CC=C2C1=O
| PubChem CID | 11769822 |
|---|---|
| CAS | 6097-07-0 |
| Molecular Weight (g/mol) | 213.23 |
| MDL Number | MFCD06798110 |
| SMILES | C#CCCCN1C(=O)C2=CC=CC=C2C1=O |
| Synonym | n-4-pentynyl phthalimide,2-pent-4-ynyl isoindoline-1,3-dione,1-phthalimido-4-pentyne,2-pent-4-yn-1-yl isoindoline-1,3-dione,n-4-pentynyl phthalimide 97,2-pent-4-yn-1-yl isoindole-1,3-dione,5-phthalimido-1-pentyne,2-pent-4-ynyl-isoindole-1,3-dione |
| IUPAC Name | 2-pent-4-ynylisoindole-1,3-dione |
| InChI Key | YNZIPXLLPFYDGM-UHFFFAOYSA-N |
| Molecular Formula | C13H11NO2 |