Organic acids and derivatives
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Tetrasodium Ethylenediaminetetraacetate Dihydrate 98.0+%, TCI America™
CAS: 10378-23-1 Molecular Formula: C10H20N2Na4O10 Molecular Weight (g/mol): 420.233 MDL Number: MFCD00012460 InChI Key: DGWOWDJDIBPYOR-UHFFFAOYSA-N Synonym: ethylenediaminetetraacetic acid tetrasodium salt dihydrate,tetrasodium ethylenediaminetetraacetate dihydrate,edta-na4,edta tetrasodium salt,edta tetrasodium salt hydrate,ethylenediaminetetraacetic acid tetrasodium salt hydrate,64-02-8 anhydrous,ksc909a7h,edta tetrasodium salt dihydrate,tetrapotassium ion 4-edta dihydrate PubChem CID: 131843362 IUPAC Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid;sodium;dihydrate SMILES: C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.O.O.[Na].[Na].[Na].[Na]
| PubChem CID | 131843362 |
|---|---|
| CAS | 10378-23-1 |
| Molecular Weight (g/mol) | 420.233 |
| MDL Number | MFCD00012460 |
| SMILES | C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.O.O.[Na].[Na].[Na].[Na] |
| Synonym | ethylenediaminetetraacetic acid tetrasodium salt dihydrate,tetrasodium ethylenediaminetetraacetate dihydrate,edta-na4,edta tetrasodium salt,edta tetrasodium salt hydrate,ethylenediaminetetraacetic acid tetrasodium salt hydrate,64-02-8 anhydrous,ksc909a7h,edta tetrasodium salt dihydrate,tetrapotassium ion 4-edta dihydrate |
| IUPAC Name | 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid;sodium;dihydrate |
| InChI Key | DGWOWDJDIBPYOR-UHFFFAOYSA-N |
| Molecular Formula | C10H20N2Na4O10 |
Ethylenediaminetetraacetic Acid Monosodium Ferric Salt Hydrate 90.0+%, TCI America™
CAS: 15708-41-5 Molecular Formula: C10H12FeN2NaO8 Molecular Weight (g/mol): 367.047 MDL Number: MFCD00078215 InChI Key: MKWYFZFMAMBPQK-UHFFFAOYSA-J Synonym: sodium feredetate,edta ferric sodium salt,calmosine,sodium ironedetate,edta iron iii sodium salt,ferisan,sytron,sequestrene nafe,sodium iron edta,ferric sodium edta PubChem CID: 27461 ChEBI: CHEBI:78292 IUPAC Name: sodium;2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;iron(3+) SMILES: C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Fe+3]
| PubChem CID | 27461 |
|---|---|
| CAS | 15708-41-5 |
| Molecular Weight (g/mol) | 367.047 |
| ChEBI | CHEBI:78292 |
| MDL Number | MFCD00078215 |
| SMILES | C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Fe+3] |
| Synonym | sodium feredetate,edta ferric sodium salt,calmosine,sodium ironedetate,edta iron iii sodium salt,ferisan,sytron,sequestrene nafe,sodium iron edta,ferric sodium edta |
| IUPAC Name | sodium;2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;iron(3+) |
| InChI Key | MKWYFZFMAMBPQK-UHFFFAOYSA-J |
| Molecular Formula | C10H12FeN2NaO8 |
Barium Disodium Ethylenediaminetetraacetate Hydrate 98.0+%, TCI America™
CAS: 18744-58-6 Molecular Formula: C10H12BaN2O8 Molecular Weight (g/mol): 425.54 MDL Number: MFCD00054444 InChI Key: MASKRDCJSCCWNE-UHFFFAOYSA-J Synonym: Ethylenediaminetetraacetic Acid Disodium Barium Salt, Disodium Barium Ethylenediaminetetraacetate, Ethylenediaminetetraacetic Acid Barium Disodium Salt PubChem CID: 102601892 IUPAC Name: barium(2+) 2-({2-[bis(carboxylatomethyl)amino]ethyl}(carboxylatomethyl)amino)acetate SMILES: [Ba++].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O
| PubChem CID | 102601892 |
|---|---|
| CAS | 18744-58-6 |
| Molecular Weight (g/mol) | 425.54 |
| MDL Number | MFCD00054444 |
| SMILES | [Ba++].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O |
| Synonym | Ethylenediaminetetraacetic Acid Disodium Barium Salt, Disodium Barium Ethylenediaminetetraacetate, Ethylenediaminetetraacetic Acid Barium Disodium Salt |
| IUPAC Name | barium(2+) 2-({2-[bis(carboxylatomethyl)amino]ethyl}(carboxylatomethyl)amino)acetate |
| InChI Key | MASKRDCJSCCWNE-UHFFFAOYSA-J |
| Molecular Formula | C10H12BaN2O8 |
Diethyl Carbonate 98.0+%, TCI America™
CAS: 105-58-8 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.13 MDL Number: MFCD00009107 InChI Key: OIFBSDVPJOWBCH-UHFFFAOYSA-N Synonym: ethyl carbonate,carbonic acid, diethyl ester,carbonic acid diethyl ester,eufin,diatol,diaethylcarbonat,carbonic ether,ethoxyformic anhydride,diethylkarbonat,ethyl carbonate eto 2co PubChem CID: 7766 IUPAC Name: diethyl carbonate SMILES: CCOC(=O)OCC
| PubChem CID | 7766 |
|---|---|
| CAS | 105-58-8 |
| Molecular Weight (g/mol) | 118.13 |
| MDL Number | MFCD00009107 |
| SMILES | CCOC(=O)OCC |
| Synonym | ethyl carbonate,carbonic acid, diethyl ester,carbonic acid diethyl ester,eufin,diatol,diaethylcarbonat,carbonic ether,ethoxyformic anhydride,diethylkarbonat,ethyl carbonate eto 2co |
| IUPAC Name | diethyl carbonate |
| InChI Key | OIFBSDVPJOWBCH-UHFFFAOYSA-N |
| Molecular Formula | C5H10O3 |
2,5-Dimethyl-4-methoxy-3(2H)-furanone 97.0+%, TCI America™
CAS: 4077-47-8 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.15 MDL Number: MFCD00209504 InChI Key: SIMKGHMLPVDSJE-UHFFFAOYNA-N PubChem CID: 61325 IUPAC Name: 4-methoxy-2,5-dimethyl-2,3-dihydrofuran-3-one SMILES: COC1=C(C)OC(C)C1=O
| PubChem CID | 61325 |
|---|---|
| CAS | 4077-47-8 |
| Molecular Weight (g/mol) | 142.15 |
| MDL Number | MFCD00209504 |
| SMILES | COC1=C(C)OC(C)C1=O |
| IUPAC Name | 4-methoxy-2,5-dimethyl-2,3-dihydrofuran-3-one |
| InChI Key | SIMKGHMLPVDSJE-UHFFFAOYNA-N |
| Molecular Formula | C7H10O3 |
2,3-Dimethyl-1-phenyl-5-pyrazolone 99.0+%, TCI America™
CAS: 60-80-0 Molecular Formula: C11H12N2O Molecular Weight (g/mol): 188.23 MDL Number: MFCD00003146 InChI Key: VEQOALNAAJBPNY-UHFFFAOYSA-N Synonym: antipyrine,phenazone,antipyrin,phenazon,analgesine,anodynine,anodynin,azophen,fenazone,2,3-dimethyl-1-phenyl-5-pyrazolone PubChem CID: 2206 ChEBI: CHEBI:31225 IUPAC Name: 1,5-dimethyl-2-phenylpyrazol-3-one SMILES: CC1=CC(=O)N(N1C)C2=CC=CC=C2
| PubChem CID | 2206 |
|---|---|
| CAS | 60-80-0 |
| Molecular Weight (g/mol) | 188.23 |
| ChEBI | CHEBI:31225 |
| MDL Number | MFCD00003146 |
| SMILES | CC1=CC(=O)N(N1C)C2=CC=CC=C2 |
| Synonym | antipyrine,phenazone,antipyrin,phenazon,analgesine,anodynine,anodynin,azophen,fenazone,2,3-dimethyl-1-phenyl-5-pyrazolone |
| IUPAC Name | 1,5-dimethyl-2-phenylpyrazol-3-one |
| InChI Key | VEQOALNAAJBPNY-UHFFFAOYSA-N |
| Molecular Formula | C11H12N2O |
Domperidone 98.0+%, TCI America™
CAS: 57808-66-9 Molecular Formula: C22H24ClN5O2 Molecular Weight (g/mol): 425.917 MDL Number: MFCD00069256 InChI Key: FGXWKSZFVQUSTL-UHFFFAOYSA-N Synonym: domperidone,motilium,nauzelin,domperidonum,domperidona,domperidon,domperidonum inn-latin,domperidona inn-spanish,motillium,motinorm PubChem CID: 3151 ChEBI: CHEBI:31515 IUPAC Name: 6-chloro-3-[1-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]piperidin-4-yl]-1H-benzimidazol-2-one SMILES: C1CN(CCC1N2C3=C(C=C(C=C3)Cl)NC2=O)CCCN4C5=CC=CC=C5NC4=O
| PubChem CID | 3151 |
|---|---|
| CAS | 57808-66-9 |
| Molecular Weight (g/mol) | 425.917 |
| ChEBI | CHEBI:31515 |
| MDL Number | MFCD00069256 |
| SMILES | C1CN(CCC1N2C3=C(C=C(C=C3)Cl)NC2=O)CCCN4C5=CC=CC=C5NC4=O |
| Synonym | domperidone,motilium,nauzelin,domperidonum,domperidona,domperidon,domperidonum inn-latin,domperidona inn-spanish,motillium,motinorm |
| IUPAC Name | 6-chloro-3-[1-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]piperidin-4-yl]-1H-benzimidazol-2-one |
| InChI Key | FGXWKSZFVQUSTL-UHFFFAOYSA-N |
| Molecular Formula | C22H24ClN5O2 |
Dimethyl Octafluoroadipate 97.0+%, TCI America™
CAS: 3107-98-0 Molecular Formula: C8H6F8O4 Molecular Weight (g/mol): 318.119 MDL Number: MFCD00042267 InChI Key: XPXVIIILXUOEQA-UHFFFAOYSA-N Synonym: dimethyl octafluoroadipate,dimethyl perfluoroadipate,hexanedioic acid, octafluoro-, dimethyl ester,1,6-dimethyl 2,2,3,3,4,4,5,5-octafluorohexanedioate,dimethyloctafluoroadipate,acmc-1cson,dimethyl octafluoroadipinate,dimethyl octafluorohexanedioate,perfluoroadipic acid dimethyl ester,octafluoroadipic acid dimethyl ester PubChem CID: 2737117 IUPAC Name: dimethyl 2,2,3,3,4,4,5,5-octafluorohexanedioate SMILES: COC(=O)C(C(C(C(C(=O)OC)(F)F)(F)F)(F)F)(F)F
| PubChem CID | 2737117 |
|---|---|
| CAS | 3107-98-0 |
| Molecular Weight (g/mol) | 318.119 |
| MDL Number | MFCD00042267 |
| SMILES | COC(=O)C(C(C(C(C(=O)OC)(F)F)(F)F)(F)F)(F)F |
| Synonym | dimethyl octafluoroadipate,dimethyl perfluoroadipate,hexanedioic acid, octafluoro-, dimethyl ester,1,6-dimethyl 2,2,3,3,4,4,5,5-octafluorohexanedioate,dimethyloctafluoroadipate,acmc-1cson,dimethyl octafluoroadipinate,dimethyl octafluorohexanedioate,perfluoroadipic acid dimethyl ester,octafluoroadipic acid dimethyl ester |
| IUPAC Name | dimethyl 2,2,3,3,4,4,5,5-octafluorohexanedioate |
| InChI Key | XPXVIIILXUOEQA-UHFFFAOYSA-N |
| Molecular Formula | C8H6F8O4 |
Diethyl (Hydroxymethyl)phosphonate 97.0+%, TCI America™
CAS: 3084-40-0 Molecular Formula: C5H13O4P Molecular Weight (g/mol): 168.129 MDL Number: MFCD00014418 InChI Key: RWIGWWBLTJLKMK-UHFFFAOYSA-N Synonym: diethyl hydroxymethyl phosphonate,diethyl hydroxymethylphosphonate,phosphonic acid, hydroxymethyl-, diethyl ester,hydroxymethyl phosphonic acid, diethyl ester,hydroxymethyl phosphonic acid diethyl ester,phosphonic acid, p-hydroxymethyl-, diethyl ester,acmc-1corl,diethoxyphosphoryl-methanol PubChem CID: 76513 IUPAC Name: diethoxyphosphorylmethanol SMILES: CCOP(=O)(CO)OCC
| PubChem CID | 76513 |
|---|---|
| CAS | 3084-40-0 |
| Molecular Weight (g/mol) | 168.129 |
| MDL Number | MFCD00014418 |
| SMILES | CCOP(=O)(CO)OCC |
| Synonym | diethyl hydroxymethyl phosphonate,diethyl hydroxymethylphosphonate,phosphonic acid, hydroxymethyl-, diethyl ester,hydroxymethyl phosphonic acid, diethyl ester,hydroxymethyl phosphonic acid diethyl ester,phosphonic acid, p-hydroxymethyl-, diethyl ester,acmc-1corl,diethoxyphosphoryl-methanol |
| IUPAC Name | diethoxyphosphorylmethanol |
| InChI Key | RWIGWWBLTJLKMK-UHFFFAOYSA-N |
| Molecular Formula | C5H13O4P |
(+)-Dibenzoyl-D-tartaric Acid 98.0+%, TCI America™
CAS: 17026-42-5 Molecular Formula: C18H14O8 Molecular Weight (g/mol): 358.30 MDL Number: MFCD00063222 InChI Key: YONLFQNRGZXBBF-ZCWZLOQUNA-N Synonym: dibenzoyl-d-tartaric acid,+-dibenzoyl-d-tartaric acid,2s,3s-2,3-bis benzoyloxy succinic acid,d-dibenzoyl tartaric acid,butanedioic acid, 2,3-bis benzoyloxy-, 2s,3s,+-o,o-dibenzoyltartaric acid,2s,3s-+-dibenzoyltartaric acid,+-dibenzoyltartaric acid,+-dibenzoyl tartaric acid PubChem CID: 1550213 IUPAC Name: (2S,3S)-2,3-bis(benzoyloxy)butanedioic acid SMILES: OC(=O)[C@@H](OC(=O)C1=CC=CC=C1)[C@H](OC(=O)C1=CC=CC=C1)C(O)=O
| PubChem CID | 1550213 |
|---|---|
| CAS | 17026-42-5 |
| Molecular Weight (g/mol) | 358.30 |
| MDL Number | MFCD00063222 |
| SMILES | OC(=O)[C@@H](OC(=O)C1=CC=CC=C1)[C@H](OC(=O)C1=CC=CC=C1)C(O)=O |
| Synonym | dibenzoyl-d-tartaric acid,+-dibenzoyl-d-tartaric acid,2s,3s-2,3-bis benzoyloxy succinic acid,d-dibenzoyl tartaric acid,butanedioic acid, 2,3-bis benzoyloxy-, 2s,3s,+-o,o-dibenzoyltartaric acid,2s,3s-+-dibenzoyltartaric acid,+-dibenzoyltartaric acid,+-dibenzoyl tartaric acid |
| IUPAC Name | (2S,3S)-2,3-bis(benzoyloxy)butanedioic acid |
| InChI Key | YONLFQNRGZXBBF-ZCWZLOQUNA-N |
| Molecular Formula | C18H14O8 |
5-(4-Chlorobutyl)hydantoin 97.0+%, TCI America™
CAS: 40126-55-4 Molecular Formula: C7H11ClN2O2 Molecular Weight (g/mol): 190.627 MDL Number: MFCD00059722 InChI Key: ZKHLVOULDIXSCC-UHFFFAOYSA-N PubChem CID: 229807 IUPAC Name: 5-(4-chlorobutyl)imidazolidine-2,4-dione SMILES: C(CCCl)CC1C(=O)NC(=O)N1
| PubChem CID | 229807 |
|---|---|
| CAS | 40126-55-4 |
| Molecular Weight (g/mol) | 190.627 |
| MDL Number | MFCD00059722 |
| SMILES | C(CCCl)CC1C(=O)NC(=O)N1 |
| IUPAC Name | 5-(4-chlorobutyl)imidazolidine-2,4-dione |
| InChI Key | ZKHLVOULDIXSCC-UHFFFAOYSA-N |
| Molecular Formula | C7H11ClN2O2 |
1-Benzylhydantoin 98.0+%, TCI America™
CAS: 6777-05-5 Molecular Formula: C10H10N2O2 Molecular Weight (g/mol): 190.20 MDL Number: MFCD00466790 InChI Key: VJUNTPRQTFDQMF-UHFFFAOYSA-N PubChem CID: 2735485 IUPAC Name: 1-benzylimidazolidine-2,4-dione SMILES: C1C(=O)NC(=O)N1CC2=CC=CC=C2
| PubChem CID | 2735485 |
|---|---|
| CAS | 6777-05-5 |
| Molecular Weight (g/mol) | 190.20 |
| MDL Number | MFCD00466790 |
| SMILES | C1C(=O)NC(=O)N1CC2=CC=CC=C2 |
| IUPAC Name | 1-benzylimidazolidine-2,4-dione |
| InChI Key | VJUNTPRQTFDQMF-UHFFFAOYSA-N |
| Molecular Formula | C10H10N2O2 |
(R)-(-)-4-Isopropyl-3-propionyl-2-oxazolidinone 98.0+%, TCI America™
CAS: 89028-40-0 Molecular Formula: C9H15NO3 Molecular Weight (g/mol): 185.223 MDL Number: MFCD00269691 InChI Key: HOWPHXVPNNPSAZ-ZETCQYMHSA-N Synonym: (R)-(-)-3-Propionyl-4-isopropyl-2-oxazolidinone PubChem CID: 643512 IUPAC Name: (4R)-3-propanoyl-4-propan-2-yl-1,3-oxazolidin-2-one SMILES: CCC(=O)N1C(COC1=O)C(C)C
| PubChem CID | 643512 |
|---|---|
| CAS | 89028-40-0 |
| Molecular Weight (g/mol) | 185.223 |
| MDL Number | MFCD00269691 |
| SMILES | CCC(=O)N1C(COC1=O)C(C)C |
| Synonym | (R)-(-)-3-Propionyl-4-isopropyl-2-oxazolidinone |
| IUPAC Name | (4R)-3-propanoyl-4-propan-2-yl-1,3-oxazolidin-2-one |
| InChI Key | HOWPHXVPNNPSAZ-ZETCQYMHSA-N |
| Molecular Formula | C9H15NO3 |
N-Chloromethylphthalimide 98.0+%, TCI America™
CAS: 17564-64-6 Molecular Formula: C9H6ClNO2 Molecular Weight (g/mol): 195.602 MDL Number: MFCD00005898 InChI Key: JKGLRGGCGUQNEX-UHFFFAOYSA-N Synonym: n-chloromethyl phthalimide,2-chloromethyl isoindoline-1,3-dione,n-chloromethylphthalimide,chloromethylphthalimide,n-chloromethyltrimellitimide,1h-isoindole-1,3 2h-dione, 2-chloromethyl,phthalimide, n-chloromethyl,2-chloromethyl isoindole-1,3-dione,2-chloromethyl-1h-isoindole-1,3 2h-dione PubChem CID: 87154 IUPAC Name: 2-(chloromethyl)isoindole-1,3-dione SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CCl
| PubChem CID | 87154 |
|---|---|
| CAS | 17564-64-6 |
| Molecular Weight (g/mol) | 195.602 |
| MDL Number | MFCD00005898 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCl |
| Synonym | n-chloromethyl phthalimide,2-chloromethyl isoindoline-1,3-dione,n-chloromethylphthalimide,chloromethylphthalimide,n-chloromethyltrimellitimide,1h-isoindole-1,3 2h-dione, 2-chloromethyl,phthalimide, n-chloromethyl,2-chloromethyl isoindole-1,3-dione,2-chloromethyl-1h-isoindole-1,3 2h-dione |
| IUPAC Name | 2-(chloromethyl)isoindole-1,3-dione |
| InChI Key | JKGLRGGCGUQNEX-UHFFFAOYSA-N |
| Molecular Formula | C9H6ClNO2 |
4-Amino-N-methylphthalimide 98.0+%, TCI America™
CAS: 2307-00-8 Molecular Formula: C9H8N2O2 Molecular Weight (g/mol): 176.175 MDL Number: MFCD00012081 InChI Key: KMEBUNSLFRQSEM-UHFFFAOYSA-N PubChem CID: 726931 IUPAC Name: 5-amino-2-methylisoindole-1,3-dione SMILES: CN1C(=O)C2=C(C1=O)C=C(C=C2)N
| PubChem CID | 726931 |
|---|---|
| CAS | 2307-00-8 |
| Molecular Weight (g/mol) | 176.175 |
| MDL Number | MFCD00012081 |
| SMILES | CN1C(=O)C2=C(C1=O)C=C(C=C2)N |
| IUPAC Name | 5-amino-2-methylisoindole-1,3-dione |
| InChI Key | KMEBUNSLFRQSEM-UHFFFAOYSA-N |
| Molecular Formula | C9H8N2O2 |