Organic acids and derivatives
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3-Amino-1-phenyl-2-pyrazolin-5-one 98.0+%, TCI America™
CAS: 4149-06-8 Molecular Formula: C9H9N3O Molecular Weight (g/mol): 175.19 MDL Number: MFCD00003137 InChI Key: LPOVZHYARSAVIZ-UHFFFAOYSA-N Synonym: 3-amino-1-phenyl-2-pyrazolin-5-one,3-amino-1-phenyl-1h-pyrazol-5 4h-one,3h-pyrazol-3-one, 5-amino-2,4-dihydro-2-phenyl,3-amino-1-phenyl-4,5-dihydro-1h-pyrazol-5-one,5-pyrazolone, 3-amino-1-phenyl,5-amino-2-phenyl-2,4-dihydro-3h-pyrazol-3-one,3h-pyrazol-3-one, 2,4-dihydro-5-amino-2-phenyl,2,4-dihydro-5-amino-2-phenyl-3h-pyrazol-3-one,acmc-1arey,lpovzhyarsaviz-uhfffaoysa PubChem CID: 77794 IUPAC Name: 5-amino-2-phenyl-4H-pyrazol-3-one SMILES: C1C(=NN(C1=O)C2=CC=CC=C2)N
| PubChem CID | 77794 |
|---|---|
| CAS | 4149-06-8 |
| Molecular Weight (g/mol) | 175.19 |
| MDL Number | MFCD00003137 |
| SMILES | C1C(=NN(C1=O)C2=CC=CC=C2)N |
| Synonym | 3-amino-1-phenyl-2-pyrazolin-5-one,3-amino-1-phenyl-1h-pyrazol-5 4h-one,3h-pyrazol-3-one, 5-amino-2,4-dihydro-2-phenyl,3-amino-1-phenyl-4,5-dihydro-1h-pyrazol-5-one,5-pyrazolone, 3-amino-1-phenyl,5-amino-2-phenyl-2,4-dihydro-3h-pyrazol-3-one,3h-pyrazol-3-one, 2,4-dihydro-5-amino-2-phenyl,2,4-dihydro-5-amino-2-phenyl-3h-pyrazol-3-one,acmc-1arey,lpovzhyarsaviz-uhfffaoysa |
| IUPAC Name | 5-amino-2-phenyl-4H-pyrazol-3-one |
| InChI Key | LPOVZHYARSAVIZ-UHFFFAOYSA-N |
| Molecular Formula | C9H9N3O |
Diamyl Sulfate 96.0+%, TCI America™
CAS: 5867-98-1 Molecular Formula: C10H22O4S Molecular Weight (g/mol): 238.342 MDL Number: MFCD06797095 InChI Key: GAFRWLVTHPVQGK-UHFFFAOYSA-N Synonym: Dipentyl Sulfate PubChem CID: 13459933 IUPAC Name: dipentyl sulfate SMILES: CCCCCOS(=O)(=O)OCCCCC
| PubChem CID | 13459933 |
|---|---|
| CAS | 5867-98-1 |
| Molecular Weight (g/mol) | 238.342 |
| MDL Number | MFCD06797095 |
| SMILES | CCCCCOS(=O)(=O)OCCCCC |
| Synonym | Dipentyl Sulfate |
| IUPAC Name | dipentyl sulfate |
| InChI Key | GAFRWLVTHPVQGK-UHFFFAOYSA-N |
| Molecular Formula | C10H22O4S |
(+)-Di-p-anisoyl-D-tartaric Acid 98.0+%, TCI America™
CAS: 191605-10-4 Molecular Formula: C20H18O10 Molecular Weight (g/mol): 418.35 MDL Number: MFCD07368366 InChI Key: KWWCVCFQHGKOMI-UHFFFAOYNA-N Synonym: (+)-Bis(4-methoxybenzoyl)-D-tartaric Acid PubChem CID: 9810979 IUPAC Name: 2,3-bis(4-methoxybenzoyloxy)butanedioic acid SMILES: COC1=CC=C(C=C1)C(=O)OC(C(OC(=O)C1=CC=C(OC)C=C1)C(O)=O)C(O)=O
| PubChem CID | 9810979 |
|---|---|
| CAS | 191605-10-4 |
| Molecular Weight (g/mol) | 418.35 |
| MDL Number | MFCD07368366 |
| SMILES | COC1=CC=C(C=C1)C(=O)OC(C(OC(=O)C1=CC=C(OC)C=C1)C(O)=O)C(O)=O |
| Synonym | (+)-Bis(4-methoxybenzoyl)-D-tartaric Acid |
| IUPAC Name | 2,3-bis(4-methoxybenzoyloxy)butanedioic acid |
| InChI Key | KWWCVCFQHGKOMI-UHFFFAOYNA-N |
| Molecular Formula | C20H18O10 |
3,4-Dimethoxyphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 122775-35-3 Molecular Formula: C8H11BO4 MDL Number: MFCD01074574 InChI Key: RCVDPBFUMYUKPB-UHFFFAOYSA-N PubChem CID: 2734702 IUPAC Name: (3,4-dimethoxyphenyl)boronic acid
| PubChem CID | 2734702 |
|---|---|
| CAS | 122775-35-3 |
| MDL Number | MFCD01074574 |
| IUPAC Name | (3,4-dimethoxyphenyl)boronic acid |
| InChI Key | RCVDPBFUMYUKPB-UHFFFAOYSA-N |
| Molecular Formula | C8H11BO4 |
Dimethyl (1-Diazo-2-oxopropyl)phosphonate 97.0+%, TCI America™
CAS: 90965-06-3 Molecular Formula: C5H9N2O4P Molecular Weight (g/mol): 192.111 MDL Number: MFCD07368360 InChI Key: SQHSJJGGWYIFCD-UHFFFAOYSA-N Synonym: (1-Diazo-2-oxopropyl)phosphonic Acid Dimethyl Ester, Dimethyl 1-Diazoacetonylphosphonate, 1-Diazoacetonylphosphonic Acid Dimethyl Ester, Ohira-Bestmann Reagent PubChem CID: 53397103 IUPAC Name: 1-diazonio-1-dimethoxyphosphorylprop-1-en-2-olate SMILES: CC(=C([N+]#N)P(=O)(OC)OC)[O-]
| PubChem CID | 53397103 |
|---|---|
| CAS | 90965-06-3 |
| Molecular Weight (g/mol) | 192.111 |
| MDL Number | MFCD07368360 |
| SMILES | CC(=C([N+]#N)P(=O)(OC)OC)[O-] |
| Synonym | (1-Diazo-2-oxopropyl)phosphonic Acid Dimethyl Ester, Dimethyl 1-Diazoacetonylphosphonate, 1-Diazoacetonylphosphonic Acid Dimethyl Ester, Ohira-Bestmann Reagent |
| IUPAC Name | 1-diazonio-1-dimethoxyphosphorylprop-1-en-2-olate |
| InChI Key | SQHSJJGGWYIFCD-UHFFFAOYSA-N |
| Molecular Formula | C5H9N2O4P |
2',4'-Difluoroacetanilide 98.0+%, TCI America™
CAS: 399-36-0 Molecular Formula: C8H7F2NO Molecular Weight (g/mol): 171.147 MDL Number: MFCD00032502 InChI Key: WOHLPEUHFSHZAN-UHFFFAOYSA-N Synonym: 2',4'-difluoroacetanilide,n-2,4-difluorophenyl acetamide,2,4-difluoroacetanilide,2,4-difluorophenyl acetamide,acetanilide,2,4-difluoro,acetamide, n-2,4-difluorophenyl,acetamide,n-2,4-difluorophenyl,aminobenzene, n-acetyl-2,4-difluoro,acetanilide, 2',4'-difluoro,maybridge1_001023 PubChem CID: 96093 IUPAC Name: N-(2,4-difluorophenyl)acetamide SMILES: CC(=O)NC1=C(C=C(C=C1)F)F
| PubChem CID | 96093 |
|---|---|
| CAS | 399-36-0 |
| Molecular Weight (g/mol) | 171.147 |
| MDL Number | MFCD00032502 |
| SMILES | CC(=O)NC1=C(C=C(C=C1)F)F |
| Synonym | 2',4'-difluoroacetanilide,n-2,4-difluorophenyl acetamide,2,4-difluoroacetanilide,2,4-difluorophenyl acetamide,acetanilide,2,4-difluoro,acetamide, n-2,4-difluorophenyl,acetamide,n-2,4-difluorophenyl,aminobenzene, n-acetyl-2,4-difluoro,acetanilide, 2',4'-difluoro,maybridge1_001023 |
| IUPAC Name | N-(2,4-difluorophenyl)acetamide |
| InChI Key | WOHLPEUHFSHZAN-UHFFFAOYSA-N |
| Molecular Formula | C8H7F2NO |
Dibutyl Vinylboronate (stabilized with Phenothiazine) 94.0+%, TCI America™
CAS: 6336-45-4 Molecular Formula: C10H21BO2 Molecular Weight (g/mol): 184.086 MDL Number: MFCD00050049 InChI Key: JQKJEPJLCSCBGW-UHFFFAOYSA-N Synonym: Vinylboronic Acid Dibutyl Ester PubChem CID: 236543 IUPAC Name: dibutoxy(ethenyl)borane SMILES: B(C=C)(OCCCC)OCCCC
| PubChem CID | 236543 |
|---|---|
| CAS | 6336-45-4 |
| Molecular Weight (g/mol) | 184.086 |
| MDL Number | MFCD00050049 |
| SMILES | B(C=C)(OCCCC)OCCCC |
| Synonym | Vinylboronic Acid Dibutyl Ester |
| IUPAC Name | dibutoxy(ethenyl)borane |
| InChI Key | JQKJEPJLCSCBGW-UHFFFAOYSA-N |
| Molecular Formula | C10H21BO2 |
Adipamide 98.0+%, TCI America™
CAS: 628-94-4 Molecular Formula: C6H12N2O2 Molecular Weight (g/mol): 144.174 MDL Number: MFCD00008045 InChI Key: GVNWZKBFMFUVNX-UHFFFAOYSA-N Synonym: adipamide,adipic diamide,adipic acid amide,adipic acid diamide,1,4-butanedicarboxamide,1,2-ethylenebisacetamide,unii-40dru033ow,ccris 5883,butane-1,4-dicarboxamide,hexanedioic diamide PubChem CID: 12364 IUPAC Name: hexanediamide SMILES: C(CCC(=O)N)CC(=O)N
| PubChem CID | 12364 |
|---|---|
| CAS | 628-94-4 |
| Molecular Weight (g/mol) | 144.174 |
| MDL Number | MFCD00008045 |
| SMILES | C(CCC(=O)N)CC(=O)N |
| Synonym | adipamide,adipic diamide,adipic acid amide,adipic acid diamide,1,4-butanedicarboxamide,1,2-ethylenebisacetamide,unii-40dru033ow,ccris 5883,butane-1,4-dicarboxamide,hexanedioic diamide |
| IUPAC Name | hexanediamide |
| InChI Key | GVNWZKBFMFUVNX-UHFFFAOYSA-N |
| Molecular Formula | C6H12N2O2 |
5-Chloro-1-(4-piperidinyl)-2-benzimidazolinone 98.0+%, TCI America™
CAS: 53786-28-0 Molecular Formula: C12H14ClN3O Molecular Weight (g/mol): 251.714 MDL Number: MFCD02093793 InChI Key: DOAYWDKFDPSTSV-UHFFFAOYSA-N Synonym: 5-chloro-1-4-piperidyl-2-benzimidazolinone,5-chloro-1-piperidin-4-yl-1h-benzo d imidazol-2 3h-one,1-4-piperidinyl-1,3-dihydro-5-chlorobenzimidazolone,5-chloro-1,3-dihydro-1-4-piperidinyl-2h-benzimidazol-2-one,domperidone impurity a,5-chloro-1-piperidin-4-yl-1,3-dihydro-2h-benzimidazol-2-one,5-chloro-1-piperidin-4-yl-1,3-dihydro-benzoimidazol-2-one,4-5-chloro-2-oxo-2h-benzimidazol-1-yl piperidine,5-chloro-1-4-piperidyl-3-hydrobenzimidazol-2-one PubChem CID: 104607 IUPAC Name: 6-chloro-3-piperidin-4-yl-1H-benzimidazol-2-one SMILES: C1CNCCC1N2C3=C(C=C(C=C3)Cl)NC2=O
| PubChem CID | 104607 |
|---|---|
| CAS | 53786-28-0 |
| Molecular Weight (g/mol) | 251.714 |
| MDL Number | MFCD02093793 |
| SMILES | C1CNCCC1N2C3=C(C=C(C=C3)Cl)NC2=O |
| Synonym | 5-chloro-1-4-piperidyl-2-benzimidazolinone,5-chloro-1-piperidin-4-yl-1h-benzo d imidazol-2 3h-one,1-4-piperidinyl-1,3-dihydro-5-chlorobenzimidazolone,5-chloro-1,3-dihydro-1-4-piperidinyl-2h-benzimidazol-2-one,domperidone impurity a,5-chloro-1-piperidin-4-yl-1,3-dihydro-2h-benzimidazol-2-one,5-chloro-1-piperidin-4-yl-1,3-dihydro-benzoimidazol-2-one,4-5-chloro-2-oxo-2h-benzimidazol-1-yl piperidine,5-chloro-1-4-piperidyl-3-hydrobenzimidazol-2-one |
| IUPAC Name | 6-chloro-3-piperidin-4-yl-1H-benzimidazol-2-one |
| InChI Key | DOAYWDKFDPSTSV-UHFFFAOYSA-N |
| Molecular Formula | C12H14ClN3O |
N-(4-Chloro-3-cyano-7-ethoxy-6-quinolinyl)acetamide 98.0+%, TCI America™
CAS: 848133-76-6 Molecular Formula: C14H12ClN3O2 Molecular Weight (g/mol): 289.72 MDL Number: MFCD09263704 InChI Key: XDXGFTCQRAQEEG-UHFFFAOYSA-N PubChem CID: 11358234 IUPAC Name: N-(4-chloro-3-cyano-7-ethoxyquinolin-6-yl)acetamide SMILES: CCOC1=C(NC(C)=O)C=C2C(Cl)=C(C=NC2=C1)C#N
| PubChem CID | 11358234 |
|---|---|
| CAS | 848133-76-6 |
| Molecular Weight (g/mol) | 289.72 |
| MDL Number | MFCD09263704 |
| SMILES | CCOC1=C(NC(C)=O)C=C2C(Cl)=C(C=NC2=C1)C#N |
| IUPAC Name | N-(4-chloro-3-cyano-7-ethoxyquinolin-6-yl)acetamide |
| InChI Key | XDXGFTCQRAQEEG-UHFFFAOYSA-N |
| Molecular Formula | C14H12ClN3O2 |
Propyl Propionate 98.0+%, TCI America™
CAS: 106-36-5 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009373 InChI Key: MCSINKKTEDDPNK-UHFFFAOYSA-N Synonym: propyl propionate,n-propyl propionate,propanoic acid, propyl ester,n-propyl propanoate,propionic acid, propyl ester,n-propyl n-propionate,propylester kyseliny propionove,unii-g09trv00gk,propyl propionate natural,propionic acid n-propyl ester PubChem CID: 7803 IUPAC Name: propyl propanoate SMILES: CCCOC(=O)CC
| PubChem CID | 7803 |
|---|---|
| CAS | 106-36-5 |
| Molecular Weight (g/mol) | 116.16 |
| MDL Number | MFCD00009373 |
| SMILES | CCCOC(=O)CC |
| Synonym | propyl propionate,n-propyl propionate,propanoic acid, propyl ester,n-propyl propanoate,propionic acid, propyl ester,n-propyl n-propionate,propylester kyseliny propionove,unii-g09trv00gk,propyl propionate natural,propionic acid n-propyl ester |
| IUPAC Name | propyl propanoate |
| InChI Key | MCSINKKTEDDPNK-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
Ethyl Propiolate 98.0+%, TCI America™
CAS: 623-47-2 Molecular Formula: C5H6O2 Molecular Weight (g/mol): 98.10 MDL Number: MFCD00009184 InChI Key: FMVJYQGSRWVMQV-UHFFFAOYSA-N Synonym: ethyl propiolate,ethyl acetylenecarboxylate,2-propynoic acid, ethyl ester,propiolic acid ethyl ester,ethyl propynoate,ethoxycarbonyl acetylene,ethyl 2-propynoate,propiolic acid, ethyl ester,unii-w235g5u52s,propynoic acid ethyl ester PubChem CID: 12182 ChEBI: CHEBI:51740 IUPAC Name: ethyl prop-2-ynoate SMILES: CCOC(=O)C#C
| PubChem CID | 12182 |
|---|---|
| CAS | 623-47-2 |
| Molecular Weight (g/mol) | 98.10 |
| ChEBI | CHEBI:51740 |
| MDL Number | MFCD00009184 |
| SMILES | CCOC(=O)C#C |
| Synonym | ethyl propiolate,ethyl acetylenecarboxylate,2-propynoic acid, ethyl ester,propiolic acid ethyl ester,ethyl propynoate,ethoxycarbonyl acetylene,ethyl 2-propynoate,propiolic acid, ethyl ester,unii-w235g5u52s,propynoic acid ethyl ester |
| IUPAC Name | ethyl prop-2-ynoate |
| InChI Key | FMVJYQGSRWVMQV-UHFFFAOYSA-N |
| Molecular Formula | C5H6O2 |
Vinyl Pivalate (stabilized with HQ) 99.0+%, TCI America™
CAS: 3377-92-2 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.171 MDL Number: MFCD00059211 InChI Key: YCUBDDIKWLELPD-UHFFFAOYSA-N Synonym: Pivalic Acid Vinyl Ester, Trimethylacetic Acid Vinyl Ester, Vinyl Trimethylacetate PubChem CID: 256591 IUPAC Name: ethenyl 2,2-dimethylpropanoate SMILES: CC(C)(C)C(=O)OC=C
| PubChem CID | 256591 |
|---|---|
| CAS | 3377-92-2 |
| Molecular Weight (g/mol) | 128.171 |
| MDL Number | MFCD00059211 |
| SMILES | CC(C)(C)C(=O)OC=C |
| Synonym | Pivalic Acid Vinyl Ester, Trimethylacetic Acid Vinyl Ester, Vinyl Trimethylacetate |
| IUPAC Name | ethenyl 2,2-dimethylpropanoate |
| InChI Key | YCUBDDIKWLELPD-UHFFFAOYSA-N |
| Molecular Formula | C7H12O2 |
Sodium 4-Hydroxybenzenesulfonate 98.0+%, TCI America™
CAS: 825-90-1 Molecular Formula: C6H5NaO4S Molecular Weight (g/mol): 196.152 MDL Number: MFCD00044734 InChI Key: BYMHXIQVEAYSJD-UHFFFAOYSA-M Synonym: sodium 4-hydroxybenzenesulfonate,monosodium 4-phenolsulfonate,sodium p-hydroxybenzenesulfonate,p-phenolsulfonic acid sodium salt,unii-95h8x8yvqr,benzenesulfonic acid, 4-hydroxy-, monosodium salt,sodium p-phenolsulfonate,95h8x8yvqr,4-phenolsulfonic acid, sodium salt,sodium 4-hydroxybenzene-1-sulfonate PubChem CID: 4379756 IUPAC Name: sodium;4-hydroxybenzenesulfonate SMILES: C1=CC(=CC=C1O)S(=O)(=O)[O-].[Na+]
| PubChem CID | 4379756 |
|---|---|
| CAS | 825-90-1 |
| Molecular Weight (g/mol) | 196.152 |
| MDL Number | MFCD00044734 |
| SMILES | C1=CC(=CC=C1O)S(=O)(=O)[O-].[Na+] |
| Synonym | sodium 4-hydroxybenzenesulfonate,monosodium 4-phenolsulfonate,sodium p-hydroxybenzenesulfonate,p-phenolsulfonic acid sodium salt,unii-95h8x8yvqr,benzenesulfonic acid, 4-hydroxy-, monosodium salt,sodium p-phenolsulfonate,95h8x8yvqr,4-phenolsulfonic acid, sodium salt,sodium 4-hydroxybenzene-1-sulfonate |
| IUPAC Name | sodium;4-hydroxybenzenesulfonate |
| InChI Key | BYMHXIQVEAYSJD-UHFFFAOYSA-M |
| Molecular Formula | C6H5NaO4S |
Phenylphosphonic Acid Disodium Salt Hydrate 98.0+%, TCI America™
CAS: 25148-85-0 Molecular Formula: C6H5Na2O3P Molecular Weight (g/mol): 202.056 MDL Number: MFCD00058972 InChI Key: JOQAMSDLZYQHMX-UHFFFAOYSA-L Synonym: Benzenephosphonic Acid Disodium Salt PubChem CID: 12499978 IUPAC Name: disodium;dioxido-oxo-phenyl-$l^{5}-phosphane SMILES: C1=CC=C(C=C1)P(=O)([O-])[O-].[Na+].[Na+]
| PubChem CID | 12499978 |
|---|---|
| CAS | 25148-85-0 |
| Molecular Weight (g/mol) | 202.056 |
| MDL Number | MFCD00058972 |
| SMILES | C1=CC=C(C=C1)P(=O)([O-])[O-].[Na+].[Na+] |
| Synonym | Benzenephosphonic Acid Disodium Salt |
| IUPAC Name | disodium;dioxido-oxo-phenyl-$l^{5}-phosphane |
| InChI Key | JOQAMSDLZYQHMX-UHFFFAOYSA-L |
| Molecular Formula | C6H5Na2O3P |