Organic acids and derivatives
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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 |
1,3,2-Dioxathiolane 2,2-Dioxide 98.0+%, TCI America™
CAS: 1072-53-3 Molecular Formula: C2H4O4S Molecular Weight (g/mol): 124.11 MDL Number: MFCD00221769 InChI Key: ZPFAVCIQZKRBGF-UHFFFAOYSA-N Synonym: ethylenesulfate,ethylene sulfate,ethylene glycol, cyclic sulfate,glycol sulfate,1,2-ethylene sulfate,1,3,2-dioxathiolane, 2,2-dioxide,sulfuric acid, cyclic ethylene ester,1,3,2-dioxathiolane-2,2-dioxide,1,3,2??-dioxathiolane-2,2-dione,ethosulfate PubChem CID: 14075 IUPAC Name: 1,3,2-dioxathiolane 2,2-dioxide SMILES: C1COS(=O)(=O)O1
| PubChem CID | 14075 |
|---|---|
| CAS | 1072-53-3 |
| Molecular Weight (g/mol) | 124.11 |
| MDL Number | MFCD00221769 |
| SMILES | C1COS(=O)(=O)O1 |
| Synonym | ethylenesulfate,ethylene sulfate,ethylene glycol, cyclic sulfate,glycol sulfate,1,2-ethylene sulfate,1,3,2-dioxathiolane, 2,2-dioxide,sulfuric acid, cyclic ethylene ester,1,3,2-dioxathiolane-2,2-dioxide,1,3,2??-dioxathiolane-2,2-dione,ethosulfate |
| IUPAC Name | 1,3,2-dioxathiolane 2,2-dioxide |
| InChI Key | ZPFAVCIQZKRBGF-UHFFFAOYSA-N |
| Molecular Formula | C2H4O4S |
4-Acetamidopyridine 98.0+%, TCI America™
CAS: 5221-42-1 Molecular Formula: C7H8N2O Molecular Weight (g/mol): 136.154 InChI Key: BIJAWQUBRNHZGE-UHFFFAOYSA-N Synonym: N-(4-Pyridyl)acetamide PubChem CID: 21288 IUPAC Name: N-pyridin-4-ylacetamide SMILES: CC(=O)NC1=CC=NC=C1
| PubChem CID | 21288 |
|---|---|
| CAS | 5221-42-1 |
| Molecular Weight (g/mol) | 136.154 |
| SMILES | CC(=O)NC1=CC=NC=C1 |
| Synonym | N-(4-Pyridyl)acetamide |
| IUPAC Name | N-pyridin-4-ylacetamide |
| InChI Key | BIJAWQUBRNHZGE-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2O |
N-Methylnicotinamide 98.0+%, TCI America™
CAS: 114-33-0 Molecular Formula: C7H8N2O Molecular Weight (g/mol): 136.154 MDL Number: MFCD00006384 InChI Key: ZYVXHFWBYUDDBM-UHFFFAOYSA-N PubChem CID: 64950 ChEBI: CHEBI:64399 IUPAC Name: N-methylpyridine-3-carboxamide SMILES: CNC(=O)C1=CN=CC=C1
| PubChem CID | 64950 |
|---|---|
| CAS | 114-33-0 |
| Molecular Weight (g/mol) | 136.154 |
| ChEBI | CHEBI:64399 |
| MDL Number | MFCD00006384 |
| SMILES | CNC(=O)C1=CN=CC=C1 |
| IUPAC Name | N-methylpyridine-3-carboxamide |
| InChI Key | ZYVXHFWBYUDDBM-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2O |
Cyclohexyl Methacrylate (stabilized with MEHQ) 98.0+%, TCI America™
CAS: 101-43-9 Molecular Formula: C10H16O2 Molecular Weight (g/mol): 168.24 MDL Number: MFCD00014292 InChI Key: OIWOHHBRDFKZNC-UHFFFAOYSA-N Synonym: cyclohexyl methacrylate,methacrylic acid, cyclohexyl ester,2-propenoic acid, 2-methyl-, cyclohexyl ester,unii-5l9uuv9t6q,2-methyl-2-propenoic acid cyclohexyl ester,5l9uuv9t6q,methacrylic acid cyclohexyl ester,ageflex chma,c-hma,cyclo hexyl methacrylate PubChem CID: 7561 IUPAC Name: cyclohexyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OC1CCCCC1
| PubChem CID | 7561 |
|---|---|
| CAS | 101-43-9 |
| Molecular Weight (g/mol) | 168.24 |
| MDL Number | MFCD00014292 |
| SMILES | CC(=C)C(=O)OC1CCCCC1 |
| Synonym | cyclohexyl methacrylate,methacrylic acid, cyclohexyl ester,2-propenoic acid, 2-methyl-, cyclohexyl ester,unii-5l9uuv9t6q,2-methyl-2-propenoic acid cyclohexyl ester,5l9uuv9t6q,methacrylic acid cyclohexyl ester,ageflex chma,c-hma,cyclo hexyl methacrylate |
| IUPAC Name | cyclohexyl 2-methylprop-2-enoate |
| InChI Key | OIWOHHBRDFKZNC-UHFFFAOYSA-N |
| Molecular Formula | C10H16O2 |
N-(Hydroxymethyl)acrylamide 98.0+%, TCI America™
CAS: 924-42-5 Molecular Formula: C4H7NO2 Molecular Weight (g/mol): 101.105 MDL Number: MFCD00004597 InChI Key: CNCOEDDPFOAUMB-UHFFFAOYSA-N Synonym: n-methylolacrylamide,n-hydroxymethyl acrylamide,n-methanolacrylamide,monomethylolacrylamide,methylolacrylamide,n-methylol acrylamide,2-propenamide, n-hydroxymethyl,acrylamide, n-hydroxymethyl,uramine t 80,n-hydroxymethyl-2-propenamide PubChem CID: 13543 ChEBI: CHEBI:82492 IUPAC Name: N-(hydroxymethyl)prop-2-enamide SMILES: C=CC(=O)NCO
| PubChem CID | 13543 |
|---|---|
| CAS | 924-42-5 |
| Molecular Weight (g/mol) | 101.105 |
| ChEBI | CHEBI:82492 |
| MDL Number | MFCD00004597 |
| SMILES | C=CC(=O)NCO |
| Synonym | n-methylolacrylamide,n-hydroxymethyl acrylamide,n-methanolacrylamide,monomethylolacrylamide,methylolacrylamide,n-methylol acrylamide,2-propenamide, n-hydroxymethyl,acrylamide, n-hydroxymethyl,uramine t 80,n-hydroxymethyl-2-propenamide |
| IUPAC Name | N-(hydroxymethyl)prop-2-enamide |
| InChI Key | CNCOEDDPFOAUMB-UHFFFAOYSA-N |
| Molecular Formula | C4H7NO2 |
Hexyl Methacrylate (stabilized with MEHQ) 98.0+%, TCI America™
CAS: 142-09-6 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.25 MDL Number: MFCD00015283 InChI Key: LNCPIMCVTKXXOY-UHFFFAOYSA-N Synonym: hexyl methacrylate,n-hexyl methacrylate,hexyl 2-methyl-2-propenoate,methacrylic acid, hexyl ester,2-propenoic acid, 2-methyl-, hexyl ester,unii-538b2q3hsv,ccris 4824,hexyl 2-methylacrylate,methacrylic acid hexyl ester,dsstox_cid_5406 PubChem CID: 8872 IUPAC Name: hexyl 2-methylprop-2-enoate SMILES: CCCCCCOC(=O)C(C)=C
| PubChem CID | 8872 |
|---|---|
| CAS | 142-09-6 |
| Molecular Weight (g/mol) | 170.25 |
| MDL Number | MFCD00015283 |
| SMILES | CCCCCCOC(=O)C(C)=C |
| Synonym | hexyl methacrylate,n-hexyl methacrylate,hexyl 2-methyl-2-propenoate,methacrylic acid, hexyl ester,2-propenoic acid, 2-methyl-, hexyl ester,unii-538b2q3hsv,ccris 4824,hexyl 2-methylacrylate,methacrylic acid hexyl ester,dsstox_cid_5406 |
| IUPAC Name | hexyl 2-methylprop-2-enoate |
| InChI Key | LNCPIMCVTKXXOY-UHFFFAOYSA-N |
| Molecular Formula | C10H18O2 |
Bromoacetic Acid 98.0+%, TCI America™
CAS: 79-08-3 Molecular Formula: C2H3BrO2 Molecular Weight (g/mol): 138.948 MDL Number: MFCD00002678 InChI Key: KDPAWGWELVVRCH-UHFFFAOYSA-N Synonym: bromoacetic acid,monobromoacetic acid,bromoethanoic acid,acetic acid, bromo,to ntu,bromoacetate ion,acide bromacetique,2-bromoacetyl group,2-bromoethanoic acid,acetic acid, 2-bromo PubChem CID: 6227 IUPAC Name: 2-bromoacetic acid SMILES: C(C(=O)O)Br
| PubChem CID | 6227 |
|---|---|
| CAS | 79-08-3 |
| Molecular Weight (g/mol) | 138.948 |
| MDL Number | MFCD00002678 |
| SMILES | C(C(=O)O)Br |
| Synonym | bromoacetic acid,monobromoacetic acid,bromoethanoic acid,acetic acid, bromo,to ntu,bromoacetate ion,acide bromacetique,2-bromoacetyl group,2-bromoethanoic acid,acetic acid, 2-bromo |
| IUPAC Name | 2-bromoacetic acid |
| InChI Key | KDPAWGWELVVRCH-UHFFFAOYSA-N |
| Molecular Formula | C2H3BrO2 |
Bis[(pinacolato)boryl]methane 95.0+%, TCI America™
CAS: 78782-17-9 Molecular Formula: C13H26B2O4 Molecular Weight (g/mol): 267.97 MDL Number: MFCD27977747 InChI Key: MQYZGGWWHUGYDR-UHFFFAOYSA-N PubChem CID: 11311685 IUPAC Name: 4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane SMILES: CC1(C)OB(CB2OC(C)(C)C(C)(C)O2)OC1(C)C
| PubChem CID | 11311685 |
|---|---|
| CAS | 78782-17-9 |
| Molecular Weight (g/mol) | 267.97 |
| MDL Number | MFCD27977747 |
| SMILES | CC1(C)OB(CB2OC(C)(C)C(C)(C)O2)OC1(C)C |
| IUPAC Name | 4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane |
| InChI Key | MQYZGGWWHUGYDR-UHFFFAOYSA-N |
| Molecular Formula | C13H26B2O4 |
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 |
N,N-Diethylacrylamide (stabilized with MEHQ) 98.0+%, TCI America™
CAS: 2675-94-7 Molecular Formula: C7H13NO Molecular Weight (g/mol): 127.187 MDL Number: MFCD00078408 InChI Key: OVHHHVAVHBHXAK-UHFFFAOYSA-N PubChem CID: 17583 IUPAC Name: N,N-diethylprop-2-enamide SMILES: CCN(CC)C(=O)C=C
| PubChem CID | 17583 |
|---|---|
| CAS | 2675-94-7 |
| Molecular Weight (g/mol) | 127.187 |
| MDL Number | MFCD00078408 |
| SMILES | CCN(CC)C(=O)C=C |
| IUPAC Name | N,N-diethylprop-2-enamide |
| InChI Key | OVHHHVAVHBHXAK-UHFFFAOYSA-N |
| Molecular Formula | C7H13NO |
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 |
Disodium 4-Nitrophenyl Phosphate Hexahydrate 98.0+%, TCI America™
CAS: 333338-18-4 Molecular Formula: C6H16NNa2O12P Molecular Weight (g/mol): 371.142 MDL Number: MFCD00066288 InChI Key: KAKKHKRHCKCAGH-UHFFFAOYSA-L Synonym: Phosphoric Acid 4-Nitrophenyl Ester Disodium Salt PubChem CID: 2723710 IUPAC Name: disodium;(4-nitrophenyl) phosphate;hexahydrate SMILES: C1=CC(=CC=C1[N+](=O)[O-])OP(=O)([O-])[O-].O.O.O.O.O.O.[Na+].[Na+]
| PubChem CID | 2723710 |
|---|---|
| CAS | 333338-18-4 |
| Molecular Weight (g/mol) | 371.142 |
| MDL Number | MFCD00066288 |
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OP(=O)([O-])[O-].O.O.O.O.O.O.[Na+].[Na+] |
| Synonym | Phosphoric Acid 4-Nitrophenyl Ester Disodium Salt |
| IUPAC Name | disodium;(4-nitrophenyl) phosphate;hexahydrate |
| InChI Key | KAKKHKRHCKCAGH-UHFFFAOYSA-L |
| Molecular Formula | C6H16NNa2O12P |
Disodium L-(+)-Tartrate Dihydrate 98.0+%, TCI America™
CAS: 6106-24-7 Molecular Formula: C4H8Na2O8 Molecular Weight (g/mol): 230.08 MDL Number: MFCD00150035 InChI Key: FGJLAJMGHXGFDE-UDMGOBQRNA-L Synonym: unii-dia7c37aow,disodium tartrate dihydrate,disodium l-+-tartrate dihydrate,dia7c37aow,disodium +-tartrate dihydrate,sodium l-+-tartrate dihydrate,butanedioic acid, 2,3-dihydroxy-2r,3r-, disodium salt, dihydrate,disodium tartarate dihydrate,sodium tartrate nf,sodium tartrate dihydrate mi PubChem CID: 131855972 IUPAC Name: disodium (2R,3R)-2,3-dihydroxybutanedioate dihydrate SMILES: O.O.[Na+].[Na+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O
| PubChem CID | 131855972 |
|---|---|
| CAS | 6106-24-7 |
| Molecular Weight (g/mol) | 230.08 |
| MDL Number | MFCD00150035 |
| SMILES | O.O.[Na+].[Na+].O[C@H]([C@@H](O)C([O-])=O)C([O-])=O |
| Synonym | unii-dia7c37aow,disodium tartrate dihydrate,disodium l-+-tartrate dihydrate,dia7c37aow,disodium +-tartrate dihydrate,sodium l-+-tartrate dihydrate,butanedioic acid, 2,3-dihydroxy-2r,3r-, disodium salt, dihydrate,disodium tartarate dihydrate,sodium tartrate nf,sodium tartrate dihydrate mi |
| IUPAC Name | disodium (2R,3R)-2,3-dihydroxybutanedioate dihydrate |
| InChI Key | FGJLAJMGHXGFDE-UDMGOBQRNA-L |
| Molecular Formula | C4H8Na2O8 |
Neopentyl Glycol Diacrylate (stabilized with MEHQ) 89.0+%, TCI America™
CAS: 2223-82-7 Molecular Formula: C11H16O4 Molecular Weight (g/mol): 212.245 MDL Number: MFCD00048148 InChI Key: MXFQRSUWYYSPOC-UHFFFAOYSA-N Synonym: 2,2-Dimethyl-1,3-propanediol Diacrylate, 1,3-Bis(acryloyloxy)-2,2-dimethylpropane PubChem CID: 16680 IUPAC Name: (2,2-dimethyl-3-prop-2-enoyloxypropyl) prop-2-enoate SMILES: CC(C)(COC(=O)C=C)COC(=O)C=C
| PubChem CID | 16680 |
|---|---|
| CAS | 2223-82-7 |
| Molecular Weight (g/mol) | 212.245 |
| MDL Number | MFCD00048148 |
| SMILES | CC(C)(COC(=O)C=C)COC(=O)C=C |
| Synonym | 2,2-Dimethyl-1,3-propanediol Diacrylate, 1,3-Bis(acryloyloxy)-2,2-dimethylpropane |
| IUPAC Name | (2,2-dimethyl-3-prop-2-enoyloxypropyl) prop-2-enoate |
| InChI Key | MXFQRSUWYYSPOC-UHFFFAOYSA-N |
| Molecular Formula | C11H16O4 |