Organic acids and derivatives
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Iron(II) gluconate hydrate, 97%
CAS: 22830-45-1 Molecular Formula: C12H26FeO16 Molecular Weight (g/mol): 482.17 MDL Number: MFCD00150872 InChI Key: OKGNXSFAYMSVNN-SYAJEJNSSA-L Synonym: iron ii gluconate hydrate PubChem CID: 131851469 IUPAC Name: iron;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;dihydrate SMILES: O.O.[Fe++].OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C([O-])=O.OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C([O-])=O
| PubChem CID | 131851469 |
|---|---|
| CAS | 22830-45-1 |
| Molecular Weight (g/mol) | 482.17 |
| MDL Number | MFCD00150872 |
| SMILES | O.O.[Fe++].OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C([O-])=O.OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C([O-])=O |
| Synonym | iron ii gluconate hydrate |
| IUPAC Name | iron;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid;dihydrate |
| InChI Key | OKGNXSFAYMSVNN-SYAJEJNSSA-L |
| Molecular Formula | C12H26FeO16 |
Triformamide, 97%, Thermo Scientific™
CAS: 25891-31-0 MDL Number: MFCD08059356 InChI Key: PFBAGGWJGZAGCG-UHFFFAOYSA-N Synonym: triformamide PubChem CID: 6419719 IUPAC Name: N,N-diformylformamide SMILES: C(=O)N(C=O)C=O
| PubChem CID | 6419719 |
|---|---|
| CAS | 25891-31-0 |
| MDL Number | MFCD08059356 |
| SMILES | C(=O)N(C=O)C=O |
| Synonym | triformamide |
| IUPAC Name | N,N-diformylformamide |
| InChI Key | PFBAGGWJGZAGCG-UHFFFAOYSA-N |
Phthalimide, 99%
CAS: 85-41-6 Molecular Formula: C8H5NO2 Molecular Weight (g/mol): 147.13 MDL Number: MFCD00005881 InChI Key: XKJCHHZQLQNZHY-UHFFFAOYSA-N Synonym: phthalimide,1h-isoindole-1,3 2h-dione,o-phthalimide,isoindoline-1,3-dione,o-phthalic imide,1,3-isoindolinedione,benzoimide,2-diazoindan-1,3-dione,phenylimide,phthalimid PubChem CID: 6809 ChEBI: CHEBI:38817 IUPAC Name: isoindole-1,3-dione SMILES: O=C1NC(=O)C2=CC=CC=C12
| PubChem CID | 6809 |
|---|---|
| CAS | 85-41-6 |
| Molecular Weight (g/mol) | 147.13 |
| ChEBI | CHEBI:38817 |
| MDL Number | MFCD00005881 |
| SMILES | O=C1NC(=O)C2=CC=CC=C12 |
| Synonym | phthalimide,1h-isoindole-1,3 2h-dione,o-phthalimide,isoindoline-1,3-dione,o-phthalic imide,1,3-isoindolinedione,benzoimide,2-diazoindan-1,3-dione,phenylimide,phthalimid |
| IUPAC Name | isoindole-1,3-dione |
| InChI Key | XKJCHHZQLQNZHY-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO2 |
2,3-Dimethoxybenzeneboronic acid, 97+%
CAS: 40972-86-9 Molecular Formula: C8H11BO4 Molecular Weight (g/mol): 181.98 MDL Number: MFCD02683112 InChI Key: VREWSCMOGIXMDQ-UHFFFAOYSA-N Synonym: 2,3-dimethoxybenzeneboronic acid,2,3-dimethoxyphenyl boronic acid,boronic acid, 2,3-dimethoxyphenyl,2,3-dimethoxyphenylboronicacid,3-boronoveratrole,pubchem14109,acmc-209jhv,ksc235o1n,2,3-dimethoxy-phenylboronic acid PubChem CID: 5156491 IUPAC Name: (2,3-dimethoxyphenyl)boronic acid SMILES: COC1=CC=CC(B(O)O)=C1OC
| PubChem CID | 5156491 |
|---|---|
| CAS | 40972-86-9 |
| Molecular Weight (g/mol) | 181.98 |
| MDL Number | MFCD02683112 |
| SMILES | COC1=CC=CC(B(O)O)=C1OC |
| Synonym | 2,3-dimethoxybenzeneboronic acid,2,3-dimethoxyphenyl boronic acid,boronic acid, 2,3-dimethoxyphenyl,2,3-dimethoxyphenylboronicacid,3-boronoveratrole,pubchem14109,acmc-209jhv,ksc235o1n,2,3-dimethoxy-phenylboronic acid |
| IUPAC Name | (2,3-dimethoxyphenyl)boronic acid |
| InChI Key | VREWSCMOGIXMDQ-UHFFFAOYSA-N |
| Molecular Formula | C8H11BO4 |
N-Acetylmorpholine, 98%
CAS: 1696-20-4 Molecular Formula: C6H11NO2 Molecular Weight (g/mol): 129.159 MDL Number: MFCD00006171 InChI Key: KYWXRBNOYGGPIZ-UHFFFAOYSA-N Synonym: 4-acetylmorpholine,n-acetylmorpholine,1-morpholinoethanone,morpholine, 4-acetyl,n-acetylmorfolin,n-acetylmorfolin czech,ethanone, 1-4-morpholinyl,n-acetyl morpholine,1-morpholin-4-yl ethan-1-one,acetylmorpholine PubChem CID: 15543 IUPAC Name: 1-morpholin-4-ylethanone SMILES: CC(=O)N1CCOCC1
| PubChem CID | 15543 |
|---|---|
| CAS | 1696-20-4 |
| Molecular Weight (g/mol) | 129.159 |
| MDL Number | MFCD00006171 |
| SMILES | CC(=O)N1CCOCC1 |
| Synonym | 4-acetylmorpholine,n-acetylmorpholine,1-morpholinoethanone,morpholine, 4-acetyl,n-acetylmorfolin,n-acetylmorfolin czech,ethanone, 1-4-morpholinyl,n-acetyl morpholine,1-morpholin-4-yl ethan-1-one,acetylmorpholine |
| IUPAC Name | 1-morpholin-4-ylethanone |
| InChI Key | KYWXRBNOYGGPIZ-UHFFFAOYSA-N |
| Molecular Formula | C6H11NO2 |
Spectrum Chemical Manufacturing Corporation Dimethyl Carbonate, 99%, Spectrum™ Chemical
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CAS: 616-38-6
| CAS | 616-38-6 |
|---|
4-Acetamido-TEMPO, free radical, 98+%
CAS: 14691-89-5 Molecular Formula: C11H21N2O2 Molecular Weight (g/mol): 213.301 MDL Number: MFCD00043593 InChI Key: UXBLSWOMIHTQPH-UHFFFAOYSA-N Synonym: 4-acetamido-tempo,4-acetamido-2,2,6,6-tetramethylpiperidine 1-oxyl,4-acetamido-tempo, free radical,unii-g7abj73l6s,g7abj73l6s,4-acetylamino-2,2,6,6-tetramethylpiperidin-1-oxyl,pubchem9193,aa-tempo,4-acetamido-2,2,6,6-tetramethyl-1-piperidinyl oxidanyl PubChem CID: 518988 IUPAC Name: N-(1-$l^{1}-oxidanyl-2,2,6,6-tetramethylpiperidin-4-yl)acetamide SMILES: CC(=O)NC1CC(N(C(C1)(C)C)[O])(C)C
| PubChem CID | 518988 |
|---|---|
| CAS | 14691-89-5 |
| Molecular Weight (g/mol) | 213.301 |
| MDL Number | MFCD00043593 |
| SMILES | CC(=O)NC1CC(N(C(C1)(C)C)[O])(C)C |
| Synonym | 4-acetamido-tempo,4-acetamido-2,2,6,6-tetramethylpiperidine 1-oxyl,4-acetamido-tempo, free radical,unii-g7abj73l6s,g7abj73l6s,4-acetylamino-2,2,6,6-tetramethylpiperidin-1-oxyl,pubchem9193,aa-tempo,4-acetamido-2,2,6,6-tetramethyl-1-piperidinyl oxidanyl |
| IUPAC Name | N-(1-$l^{1}-oxidanyl-2,2,6,6-tetramethylpiperidin-4-yl)acetamide |
| InChI Key | UXBLSWOMIHTQPH-UHFFFAOYSA-N |
| Molecular Formula | C11H21N2O2 |
Strontium oxalate, 95%, Thermo Scientific Chemicals
CAS: 814-95-9 Molecular Formula: C2O4Sr Molecular Weight (g/mol): 175.638 MDL Number: MFCD00050803 InChI Key: KQAGKTURZUKUCH-UHFFFAOYSA-L Synonym: strontium oxalate,unii-7iaw7e69ni,7iaw7e69ni,strontium oxalate, src2o4,ethanedioic acid, strontium salt 1:1,oxalic acid, monostrontium salt,strontium 2+ ion oxalate,oxalic acid, strontium salt 1:1 8ci PubChem CID: 69947 IUPAC Name: strontium;oxalate SMILES: C(=O)(C(=O)[O-])[O-].[Sr+2]
| PubChem CID | 69947 |
|---|---|
| CAS | 814-95-9 |
| Molecular Weight (g/mol) | 175.638 |
| MDL Number | MFCD00050803 |
| SMILES | C(=O)(C(=O)[O-])[O-].[Sr+2] |
| Synonym | strontium oxalate,unii-7iaw7e69ni,7iaw7e69ni,strontium oxalate, src2o4,ethanedioic acid, strontium salt 1:1,oxalic acid, monostrontium salt,strontium 2+ ion oxalate,oxalic acid, strontium salt 1:1 8ci |
| IUPAC Name | strontium;oxalate |
| InChI Key | KQAGKTURZUKUCH-UHFFFAOYSA-L |
| Molecular Formula | C2O4Sr |
Nicotinic acid hydrazide, 97%
CAS: 553-53-7 Molecular Formula: C6H7N3O Molecular Weight (g/mol): 137.14 MDL Number: MFCD00006383 InChI Key: KFUSANSHCADHNJ-UHFFFAOYSA-N Synonym: nicotinohydrazide,nicotinic acid hydrazide,nicotinic hydrazide,niazid,nicotinylhydrazide,nicotinoyl hydrazine,3-pyridoyl hydrazine,3-pyridylcarbonylhydrazine,nicotinoyl hydrazide,hydrazine, nicotinoyl PubChem CID: 11112 IUPAC Name: pyridine-3-carbohydrazide SMILES: NNC(=O)C1=CC=CN=C1
| PubChem CID | 11112 |
|---|---|
| CAS | 553-53-7 |
| Molecular Weight (g/mol) | 137.14 |
| MDL Number | MFCD00006383 |
| SMILES | NNC(=O)C1=CC=CN=C1 |
| Synonym | nicotinohydrazide,nicotinic acid hydrazide,nicotinic hydrazide,niazid,nicotinylhydrazide,nicotinoyl hydrazine,3-pyridoyl hydrazine,3-pyridylcarbonylhydrazine,nicotinoyl hydrazide,hydrazine, nicotinoyl |
| IUPAC Name | pyridine-3-carbohydrazide |
| InChI Key | KFUSANSHCADHNJ-UHFFFAOYSA-N |
| Molecular Formula | C6H7N3O |
Methanesulfonic acid, pure, 70% solution in water
CAS: 75-75-2 Molecular Formula: CH4O3S Molecular Weight (g/mol): 96.1 MDL Number: MFCD00007518 InChI Key: AFVFQIVMOAPDHO-UHFFFAOYSA-N Synonym: methylsulfonic acid,methanesulphonic acid,methanesulfonicacid,kyselina methansulfonova,methansulfonsaeure,ccris 2783,kyselina methansulfonova czech,ch3so3h,methane sulfonic acid,sulfomethane PubChem CID: 6395 ChEBI: CHEBI:27376 IUPAC Name: methanesulfonic acid SMILES: CS(=O)(=O)O
| PubChem CID | 6395 |
|---|---|
| CAS | 75-75-2 |
| Molecular Weight (g/mol) | 96.1 |
| ChEBI | CHEBI:27376 |
| MDL Number | MFCD00007518 |
| SMILES | CS(=O)(=O)O |
| Synonym | methylsulfonic acid,methanesulphonic acid,methanesulfonicacid,kyselina methansulfonova,methansulfonsaeure,ccris 2783,kyselina methansulfonova czech,ch3so3h,methane sulfonic acid,sulfomethane |
| IUPAC Name | methanesulfonic acid |
| InChI Key | AFVFQIVMOAPDHO-UHFFFAOYSA-N |
| Molecular Formula | CH4O3S |
1-Dodecanesulfonic acid, sodium salt, 99+%
CAS: 2386-53-0 Molecular Formula: C12H25NaO3S Molecular Weight (g/mol): 272.38 MDL Number: MFCD00007527 InChI Key: DAJSVUQLFFJUSX-UHFFFAOYSA-M Synonym: sodium 1-dodecanesulfonate,sodium dodecane-1-sulfonate,1-dodecanesulfonic acid sodium salt,sodium laurylsulfonate,1-dodecanesulfonic acid, sodium salt,unii-4gy1kjw8si,sodium dodecyl sulfonate,4gy1kjw8si,laurylsulfonic acid sodium salt,1-dodecanesulfonic acid, sodium salt 1:1 PubChem CID: 23665726 IUPAC Name: sodium;dodecane-1-sulfonate SMILES: CCCCCCCCCCCCS(=O)(=O)[O-].[Na+]
| PubChem CID | 23665726 |
|---|---|
| CAS | 2386-53-0 |
| Molecular Weight (g/mol) | 272.38 |
| MDL Number | MFCD00007527 |
| SMILES | CCCCCCCCCCCCS(=O)(=O)[O-].[Na+] |
| Synonym | sodium 1-dodecanesulfonate,sodium dodecane-1-sulfonate,1-dodecanesulfonic acid sodium salt,sodium laurylsulfonate,1-dodecanesulfonic acid, sodium salt,unii-4gy1kjw8si,sodium dodecyl sulfonate,4gy1kjw8si,laurylsulfonic acid sodium salt,1-dodecanesulfonic acid, sodium salt 1:1 |
| IUPAC Name | sodium;dodecane-1-sulfonate |
| InChI Key | DAJSVUQLFFJUSX-UHFFFAOYSA-M |
| Molecular Formula | C12H25NaO3S |
| PubChem CID | 113227 |
|---|---|
| CAS | 867-56-1 |
| Molecular Weight (g/mol) | 112.06 |
| MDL Number | MFCD00066576 |
| SMILES | CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2C(=O)O.Cl |
| Synonym | methyl red hydrochloride,unii-rfa0w63690,4-dimethylaminoazobenzene-2'-carboxylic acid hydrochloride,eaetho masculinei 2,methyl red, acs,2-4-dimethylamino phenyl azo benzoic acid monohydrochloride,c15h15n3o2.hcl,2-e-4-dimethylamino phenyl diazenyl benzoic acid hydrochloride 1:1,methyl red hydrochloride, acs reagent,2-4-dimethylaminophenyl diazenyl benzoic acid hydrochloride |
| IUPAC Name | 2-[[4-(dimethylamino)phenyl]diazenyl]benzoic acid;hydrochloride |
| InChI Key | ICTWKXAVJAHRMK-UHFFFAOYSA-N |
| Molecular Formula | C3H5NaO3 |
1-Methyl-2-benzimidazolinone, 98%
CAS: 1849-01-0 Molecular Formula: C8H8N2O Molecular Weight (g/mol): 148.17 MDL Number: MFCD00142654 InChI Key: PYEHNKXDXBNHQQ-UHFFFAOYSA-N Synonym: 1-methyl-2-benzimidazolinone,1-methyl-1h-benzo d imidazol-2 3h-one,1-methyl-1,3-dihydro-2h-benzimidazol-2-one,1,3-dihydro-1-methyl-2h-benzimidazol-2-one,2h-benzimidazol-2-one, 1,3-dihydro-1-methyl,1-methyl-2,3-dihydro-1h-1,3-benzodiazol-2-one,1-methyl-3h-1,3-benzodiazol-2-one,n-methylbenzimidazolone,1-methylbenzimidazolone,n-methylbenzimidazolinone PubChem CID: 590540 IUPAC Name: 3-methyl-1H-benzimidazol-2-one SMILES: CN1C(=O)NC2=CC=CC=C12
| PubChem CID | 590540 |
|---|---|
| CAS | 1849-01-0 |
| Molecular Weight (g/mol) | 148.17 |
| MDL Number | MFCD00142654 |
| SMILES | CN1C(=O)NC2=CC=CC=C12 |
| Synonym | 1-methyl-2-benzimidazolinone,1-methyl-1h-benzo d imidazol-2 3h-one,1-methyl-1,3-dihydro-2h-benzimidazol-2-one,1,3-dihydro-1-methyl-2h-benzimidazol-2-one,2h-benzimidazol-2-one, 1,3-dihydro-1-methyl,1-methyl-2,3-dihydro-1h-1,3-benzodiazol-2-one,1-methyl-3h-1,3-benzodiazol-2-one,n-methylbenzimidazolone,1-methylbenzimidazolone,n-methylbenzimidazolinone |
| IUPAC Name | 3-methyl-1H-benzimidazol-2-one |
| InChI Key | PYEHNKXDXBNHQQ-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2O |
Methyl 3-(4-hydroxyphenyl)propionate, 98%
CAS: 5597-50-2 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.2 MDL Number: MFCD00071577 InChI Key: XRAMJHXWXCMGJM-UHFFFAOYSA-N Synonym: methyl 3-4-hydroxyphenyl propionate,methyl 3-4-hydroxyphenyl propanoate,benzenepropanoic acid, 4-hydroxy-, methyl ester,unii-wat13au7xb,methyl3-4-hydroxyphenyl propionate,wat13au7xb,hydrocinnamic acid, p-hydroxy-, methyl ester,3-4-hydroxyphenyl propionic acid methyl ester,methyl 3-p-hydroxyphenyl propionate,3-4'-hydroxyphenyl-propionic acid-ome PubChem CID: 79706 IUPAC Name: methyl 3-(4-hydroxyphenyl)propanoate SMILES: COC(=O)CCC1=CC=C(C=C1)O
| PubChem CID | 79706 |
|---|---|
| CAS | 5597-50-2 |
| Molecular Weight (g/mol) | 180.2 |
| MDL Number | MFCD00071577 |
| SMILES | COC(=O)CCC1=CC=C(C=C1)O |
| Synonym | methyl 3-4-hydroxyphenyl propionate,methyl 3-4-hydroxyphenyl propanoate,benzenepropanoic acid, 4-hydroxy-, methyl ester,unii-wat13au7xb,methyl3-4-hydroxyphenyl propionate,wat13au7xb,hydrocinnamic acid, p-hydroxy-, methyl ester,3-4-hydroxyphenyl propionic acid methyl ester,methyl 3-p-hydroxyphenyl propionate,3-4'-hydroxyphenyl-propionic acid-ome |
| IUPAC Name | methyl 3-(4-hydroxyphenyl)propanoate |
| InChI Key | XRAMJHXWXCMGJM-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
Spectrum Chemical Manufacturing Corporation Diethylenetriaminepentaacetic Acid, Pentasodium Salt, 41% Solution in Water, Spectrum™ Chemical
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CAS: 140-01-2 Molecular Formula: C14H18N3Na5O10 Molecular Weight (g/mol): 503.26 MDL Number: MFCD00051016 InChI Key: LQPLDXQVILYOOL-UHFFFAOYSA-I IUPAC Name: pentasodium 2-[bis({2-[bis(carboxylatomethyl)amino]ethyl})amino]acetate SMILES: [Na+].[Na+].[Na+].[Na+].[Na+].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CCN(CC([O-])=O)CC([O-])=O
| CAS | 140-01-2 |
|---|---|
| Molecular Weight (g/mol) | 503.26 |
| MDL Number | MFCD00051016 |
| SMILES | [Na+].[Na+].[Na+].[Na+].[Na+].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CCN(CC([O-])=O)CC([O-])=O |
| IUPAC Name | pentasodium 2-[bis({2-[bis(carboxylatomethyl)amino]ethyl})amino]acetate |
| InChI Key | LQPLDXQVILYOOL-UHFFFAOYSA-I |
| Molecular Formula | C14H18N3Na5O10 |