Organic acids and derivatives
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4-Isobutylcyclohexanecarboxylic Acid (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 38792-88-0 Molecular Formula: C11H20O2 Molecular Weight (g/mol): 184.279 InChI Key: NFJJRCCYQXONBL-UHFFFAOYSA-N PubChem CID: 217396 IUPAC Name: 4-(2-methylpropyl)cyclohexane-1-carboxylic acid SMILES: CC(C)CC1CCC(CC1)C(=O)O
| PubChem CID | 217396 |
|---|---|
| CAS | 38792-88-0 |
| Molecular Weight (g/mol) | 184.279 |
| SMILES | CC(C)CC1CCC(CC1)C(=O)O |
| IUPAC Name | 4-(2-methylpropyl)cyclohexane-1-carboxylic acid |
| InChI Key | NFJJRCCYQXONBL-UHFFFAOYSA-N |
| Molecular Formula | C11H20O2 |
ABTS 98.0+%, TCI America™
CAS: 30931-67-0 Molecular Formula: C18H24N6O6S4 Molecular Weight (g/mol): 548.67 MDL Number: MFCD00010404,MFCD00010404 InChI Key: OHDRQQURAXLVGJ-AXMZSLBLSA-N Synonym: ammonium 2,2'-hydrazine-1,2-diylidene bis 3-ethyl-2,3-dihydrobenzo d thiazole-6-sulfonate PubChem CID: 91884754 IUPAC Name: diammonium (2Z)-3-ethyl-2-{2-[(2Z)-3-ethyl-6-sulfonato-2,3-dihydro-1,3-benzothiazol-2-ylidene]hydrazin-1-ylidene}-2,3-dihydro-1,3-benzothiazole-6-sulfonate SMILES: [NH4+].[NH4+].CCN1\C(SC2=CC(=CC=C12)S([O-])(=O)=O)=N\N=C1/SC2=CC(=CC=C2N1CC)S([O-])(=O)=O
| PubChem CID | 91884754 |
|---|---|
| CAS | 30931-67-0 |
| Molecular Weight (g/mol) | 548.67 |
| MDL Number | MFCD00010404,MFCD00010404 |
| SMILES | [NH4+].[NH4+].CCN1\C(SC2=CC(=CC=C12)S([O-])(=O)=O)=N\N=C1/SC2=CC(=CC=C2N1CC)S([O-])(=O)=O |
| Synonym | ammonium 2,2'-hydrazine-1,2-diylidene bis 3-ethyl-2,3-dihydrobenzo d thiazole-6-sulfonate |
| IUPAC Name | diammonium (2Z)-3-ethyl-2-{2-[(2Z)-3-ethyl-6-sulfonato-2,3-dihydro-1,3-benzothiazol-2-ylidene]hydrazin-1-ylidene}-2,3-dihydro-1,3-benzothiazole-6-sulfonate |
| InChI Key | OHDRQQURAXLVGJ-AXMZSLBLSA-N |
| Molecular Formula | C18H24N6O6S4 |
Ethyl 5-Amino-1-methylpyrazole-4-carboxylate 98.0+%, TCI America™
CAS: 31037-02-2 Molecular Formula: C7H11N3O2 Molecular Weight (g/mol): 169.18 MDL Number: MFCD00051652 InChI Key: MEUSJJFWVKBUFP-UHFFFAOYSA-N Synonym: ethyl 5-amino-1-methyl-1h-pyrazole-4-carboxylate,5-amino-1-methyl-1h-pyrazole-4-carboxylic acid ethyl ester,ethyl5-amino-1-methylpyrazole-4-carboxylate,1h-pyrazole-4-carboxylic acid, 5-amino-1-methyl-, ethyl ester,5-amino-1-methylpyrazole-4-carboxylic acid ethyl ester,ethyl 5-amino-1-methyl-4-pyrazolecarboxylate,ethyl 5-amino-1-methyl-pyrazole-4-carboxylate,acmc-1agpk,maybridge1_003833,ethyl-5-amino-1-methyl-1h-pyrazol-4-carboxylat PubChem CID: 271299 IUPAC Name: ethyl 5-amino-1-methyl-1H-pyrazole-4-carboxylate SMILES: CCOC(=O)C1=C(N)N(C)N=C1
| PubChem CID | 271299 |
|---|---|
| CAS | 31037-02-2 |
| Molecular Weight (g/mol) | 169.18 |
| MDL Number | MFCD00051652 |
| SMILES | CCOC(=O)C1=C(N)N(C)N=C1 |
| Synonym | ethyl 5-amino-1-methyl-1h-pyrazole-4-carboxylate,5-amino-1-methyl-1h-pyrazole-4-carboxylic acid ethyl ester,ethyl5-amino-1-methylpyrazole-4-carboxylate,1h-pyrazole-4-carboxylic acid, 5-amino-1-methyl-, ethyl ester,5-amino-1-methylpyrazole-4-carboxylic acid ethyl ester,ethyl 5-amino-1-methyl-4-pyrazolecarboxylate,ethyl 5-amino-1-methyl-pyrazole-4-carboxylate,acmc-1agpk,maybridge1_003833,ethyl-5-amino-1-methyl-1h-pyrazol-4-carboxylat |
| IUPAC Name | ethyl 5-amino-1-methyl-1H-pyrazole-4-carboxylate |
| InChI Key | MEUSJJFWVKBUFP-UHFFFAOYSA-N |
| Molecular Formula | C7H11N3O2 |
Creatinol Phosphate 98.0+%, TCI America™
CAS: 6903-79-3 Molecular Formula: C4H12N3O4P Molecular Weight (g/mol): 197.13 MDL Number: MFCD00868297 InChI Key: FOIPWTMKYXWFGC-UHFFFAOYSA-N Synonym: 2-(1-Methylguanidino)ethyl Dihydrogen Phosphate PubChem CID: 23342 IUPAC Name: [2-(N-methylcarbamimidamido)ethoxy]phosphonic acid SMILES: CN(CCOP(O)(O)=O)C(N)=N
| PubChem CID | 23342 |
|---|---|
| CAS | 6903-79-3 |
| Molecular Weight (g/mol) | 197.13 |
| MDL Number | MFCD00868297 |
| SMILES | CN(CCOP(O)(O)=O)C(N)=N |
| Synonym | 2-(1-Methylguanidino)ethyl Dihydrogen Phosphate |
| IUPAC Name | [2-(N-methylcarbamimidamido)ethoxy]phosphonic acid |
| InChI Key | FOIPWTMKYXWFGC-UHFFFAOYSA-N |
| Molecular Formula | C4H12N3O4P |
4-Formylmorpholine 99.0+%, TCI America™
CAS: 4394-85-8 Molecular Formula: C5H9NO2 Molecular Weight (g/mol): 115.132 MDL Number: MFCD00006170 InChI Key: LCEDQNDDFOCWGG-UHFFFAOYSA-N Synonym: 4-formylmorpholine,n-formylmorpholine,4-morpholinecarboxaldehyde,morpholine, 4-formyl,n-formylmorfolin,4-morpholinecarbaldehyde,n-formylmorfolin czech,unii-d1e63xo4rh,n-formyhnorpholine,n-formyl morpholin PubChem CID: 20417 ChEBI: CHEBI:43989 IUPAC Name: morpholine-4-carbaldehyde SMILES: C1COCCN1C=O
| PubChem CID | 20417 |
|---|---|
| CAS | 4394-85-8 |
| Molecular Weight (g/mol) | 115.132 |
| ChEBI | CHEBI:43989 |
| MDL Number | MFCD00006170 |
| SMILES | C1COCCN1C=O |
| Synonym | 4-formylmorpholine,n-formylmorpholine,4-morpholinecarboxaldehyde,morpholine, 4-formyl,n-formylmorfolin,4-morpholinecarbaldehyde,n-formylmorfolin czech,unii-d1e63xo4rh,n-formyhnorpholine,n-formyl morpholin |
| IUPAC Name | morpholine-4-carbaldehyde |
| InChI Key | LCEDQNDDFOCWGG-UHFFFAOYSA-N |
| Molecular Formula | C5H9NO2 |
4-Nitrophenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 24067-17-2 Molecular Formula: C6H6BNO4 Molecular Weight (g/mol): 166.93 MDL Number: MFCD00161360 InChI Key: NSFJAFZHYOAMHL-UHFFFAOYSA-N PubChem CID: 2773552 IUPAC Name: (4-nitrophenyl)boronic acid SMILES: OB(O)C1=CC=C(C=C1)[N+]([O-])=O
| PubChem CID | 2773552 |
|---|---|
| CAS | 24067-17-2 |
| Molecular Weight (g/mol) | 166.93 |
| MDL Number | MFCD00161360 |
| SMILES | OB(O)C1=CC=C(C=C1)[N+]([O-])=O |
| IUPAC Name | (4-nitrophenyl)boronic acid |
| InChI Key | NSFJAFZHYOAMHL-UHFFFAOYSA-N |
| Molecular Formula | C6H6BNO4 |
Hafnium(IV) Trifluoromethanesulfonate 90.0+%, TCI America™
CAS: 161337-67-3 Molecular Formula: C4H2F12HfO13S4 Molecular Weight (g/mol): 792.758 MDL Number: MFCD01321255 InChI Key: XQJOFTWVKHJLHA-UHFFFAOYSA-J Synonym: hafnium iv trifluoromethanesulfonate hydrate,hafnium tetrakis trifluoromethanesulfonate , hydrate PubChem CID: 71433309 IUPAC Name: hafnium(4+);trifluoromethanesulfonate;hydrate SMILES: C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].O.[Hf+4]
| PubChem CID | 71433309 |
|---|---|
| CAS | 161337-67-3 |
| Molecular Weight (g/mol) | 792.758 |
| MDL Number | MFCD01321255 |
| SMILES | C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].O.[Hf+4] |
| Synonym | hafnium iv trifluoromethanesulfonate hydrate,hafnium tetrakis trifluoromethanesulfonate , hydrate |
| IUPAC Name | hafnium(4+);trifluoromethanesulfonate;hydrate |
| InChI Key | XQJOFTWVKHJLHA-UHFFFAOYSA-J |
| Molecular Formula | C4H2F12HfO13S4 |
Ethyl 2-Imidazolecarboxylate 98.0+%, TCI America™
CAS: 33543-78-1 Molecular Formula: C6H8N2O2 Molecular Weight (g/mol): 140.142 MDL Number: MFCD03426031 InChI Key: UHYNYIGCGVDBTC-UHFFFAOYSA-N Synonym: ethyl imidazole-2-carboxylate,1h-imidazole-2-carboxylic acid, ethyl ester,ethyl1h-imidazole-2-carboxylate,1h-imidazole-2-carboxylic acid ethyl ester,ethyl 2-imidazolecarboxylate,imidazole-2-carboxylic acid ethyl ester,2-ethoxycarbonyl-1h-imidazole,ethylimidazole-2-carboxylate,ethoxyformyl imidazole,zlchem 847 PubChem CID: 549404 IUPAC Name: ethyl 1H-imidazole-2-carboxylate SMILES: CCOC(=O)C1=NC=CN1
| PubChem CID | 549404 |
|---|---|
| CAS | 33543-78-1 |
| Molecular Weight (g/mol) | 140.142 |
| MDL Number | MFCD03426031 |
| SMILES | CCOC(=O)C1=NC=CN1 |
| Synonym | ethyl imidazole-2-carboxylate,1h-imidazole-2-carboxylic acid, ethyl ester,ethyl1h-imidazole-2-carboxylate,1h-imidazole-2-carboxylic acid ethyl ester,ethyl 2-imidazolecarboxylate,imidazole-2-carboxylic acid ethyl ester,2-ethoxycarbonyl-1h-imidazole,ethylimidazole-2-carboxylate,ethoxyformyl imidazole,zlchem 847 |
| IUPAC Name | ethyl 1H-imidazole-2-carboxylate |
| InChI Key | UHYNYIGCGVDBTC-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O2 |
N-Methylisatoic Anhydride 98.0+%, TCI America™
CAS: 10328-92-4 Molecular Formula: C9H7NO3 Molecular Weight (g/mol): 177.159 MDL Number: MFCD00006815 InChI Key: KJMRWDHBVCNLTQ-UHFFFAOYSA-N Synonym: n-methylisatoic anhydride,1-methyl-1h-benzo d 1,3 oxazine-2,4-dione,n-methyl ia,1-methyl-2h-3,1-benzoxazine-2,4 1h-dione,2h-3,1-benzoxazine-2,4 1h-dione, 1-methyl,n-methyl-n-carboxyanthranilic anhydride,methyl-n-carboxyanthranilic anhydride,1-methylbenzo d 1,3-oxazine-2,4-dione,n-methyl isotoic anhydride,1-methyl-2,4-dihydro-1h-3,1-benzoxazine-2,4-dione PubChem CID: 25160 ChEBI: CHEBI:59054 IUPAC Name: 1-methyl-3,1-benzoxazine-2,4-dione SMILES: CN1C2=CC=CC=C2C(=O)OC1=O
| PubChem CID | 25160 |
|---|---|
| CAS | 10328-92-4 |
| Molecular Weight (g/mol) | 177.159 |
| ChEBI | CHEBI:59054 |
| MDL Number | MFCD00006815 |
| SMILES | CN1C2=CC=CC=C2C(=O)OC1=O |
| Synonym | n-methylisatoic anhydride,1-methyl-1h-benzo d 1,3 oxazine-2,4-dione,n-methyl ia,1-methyl-2h-3,1-benzoxazine-2,4 1h-dione,2h-3,1-benzoxazine-2,4 1h-dione, 1-methyl,n-methyl-n-carboxyanthranilic anhydride,methyl-n-carboxyanthranilic anhydride,1-methylbenzo d 1,3-oxazine-2,4-dione,n-methyl isotoic anhydride,1-methyl-2,4-dihydro-1h-3,1-benzoxazine-2,4-dione |
| IUPAC Name | 1-methyl-3,1-benzoxazine-2,4-dione |
| InChI Key | KJMRWDHBVCNLTQ-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO3 |
Diethyl 1,1-Cyclopropanedicarboxylate 96.0+%, TCI America™
CAS: 1559-02-0 Molecular Formula: C9H14O4 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00001283 InChI Key: KYYUCZOHNYSLFV-UHFFFAOYSA-N Synonym: diethyl 1,1-cyclopropanedicarboxylate,1,1-diethyl cyclopropane-1,1-dicarboxylate,1,1-cyclopropanedicarboxylic acid diethyl ester,1,1-cyclopropanedicarboxylic acid, diethyl ester,cyclopropane-1,1-dicarboxylic acid diethyl ester,1,1-bis ethoxycarbonyl cyclopropane,diethylcyclopropan-1,1-dicarboxylat,diethyl-1,1-cyclopropanedicarboxylate,acmc-209dcw,ksc495e2n PubChem CID: 73790 IUPAC Name: 1,1-diethyl cyclopropane-1,1-dicarboxylate SMILES: CCOC(=O)C1(CC1)C(=O)OCC
| PubChem CID | 73790 |
|---|---|
| CAS | 1559-02-0 |
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD00001283 |
| SMILES | CCOC(=O)C1(CC1)C(=O)OCC |
| Synonym | diethyl 1,1-cyclopropanedicarboxylate,1,1-diethyl cyclopropane-1,1-dicarboxylate,1,1-cyclopropanedicarboxylic acid diethyl ester,1,1-cyclopropanedicarboxylic acid, diethyl ester,cyclopropane-1,1-dicarboxylic acid diethyl ester,1,1-bis ethoxycarbonyl cyclopropane,diethylcyclopropan-1,1-dicarboxylat,diethyl-1,1-cyclopropanedicarboxylate,acmc-209dcw,ksc495e2n |
| IUPAC Name | 1,1-diethyl cyclopropane-1,1-dicarboxylate |
| InChI Key | KYYUCZOHNYSLFV-UHFFFAOYSA-N |
| Molecular Formula | C9H14O4 |
2-Naphthyl Trifluoromethanesulfonate 95.0+%, TCI America™
CAS: 3857-83-8 Molecular Formula: C11H7F3O3S Molecular Weight (g/mol): 276.229 MDL Number: MFCD00192341 InChI Key: MDWRQYBWVTXIIJ-UHFFFAOYSA-N Synonym: 2-naphthyl trifluoromethanesulfonate,2-naphthyl triflate,2-naphthyltrifluoromethanesulfonate,2-naphthyltriflate,acmc-1aigh,trifluoromethanesulfonic acid 2-naphthyl ester,methanesulfonic acid, 1,1,1-trifluoro-, 2-naphthalenyl ester,methanesulfonic acid,1,1,1-trifluoro-, 2-naphthalenyl ester PubChem CID: 4546341 IUPAC Name: naphthalen-2-yl trifluoromethanesulfonate SMILES: C1=CC=C2C=C(C=CC2=C1)OS(=O)(=O)C(F)(F)F
| PubChem CID | 4546341 |
|---|---|
| CAS | 3857-83-8 |
| Molecular Weight (g/mol) | 276.229 |
| MDL Number | MFCD00192341 |
| SMILES | C1=CC=C2C=C(C=CC2=C1)OS(=O)(=O)C(F)(F)F |
| Synonym | 2-naphthyl trifluoromethanesulfonate,2-naphthyl triflate,2-naphthyltrifluoromethanesulfonate,2-naphthyltriflate,acmc-1aigh,trifluoromethanesulfonic acid 2-naphthyl ester,methanesulfonic acid, 1,1,1-trifluoro-, 2-naphthalenyl ester,methanesulfonic acid,1,1,1-trifluoro-, 2-naphthalenyl ester |
| IUPAC Name | naphthalen-2-yl trifluoromethanesulfonate |
| InChI Key | MDWRQYBWVTXIIJ-UHFFFAOYSA-N |
| Molecular Formula | C11H7F3O3S |
Glycerol Dimethacrylate (mixture of 1,2- and 1,3-form) (stabilized with MEHQ) 90.0+%, TCI America™
CAS: 1830-78-0 Molecular Formula: C11H16O5 Molecular Weight (g/mol): 228.24 MDL Number: MFCD00066299 InChI Key: OQHMGFSAURFQAF-UHFFFAOYSA-N Synonym: Bis(methacryloyloxy)propanol PubChem CID: 74594 IUPAC Name: 2-hydroxy-3-[(2-methylprop-2-enoyl)oxy]propyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCC(O)COC(=O)C(C)=C
| PubChem CID | 74594 |
|---|---|
| CAS | 1830-78-0 |
| Molecular Weight (g/mol) | 228.24 |
| MDL Number | MFCD00066299 |
| SMILES | CC(=C)C(=O)OCC(O)COC(=O)C(C)=C |
| Synonym | Bis(methacryloyloxy)propanol |
| IUPAC Name | 2-hydroxy-3-[(2-methylprop-2-enoyl)oxy]propyl 2-methylprop-2-enoate |
| InChI Key | OQHMGFSAURFQAF-UHFFFAOYSA-N |
| Molecular Formula | C11H16O5 |
Butylboronic Acid (contains varying amounts of Anhydride) [for Esterification], TCI America™
CAS: 4426-47-5 Molecular Formula: C4H11BO2 Molecular Weight (g/mol): 101.94 MDL Number: MFCD00002106 InChI Key: QPKFVRWIISEVCW-UHFFFAOYSA-N Synonym: n-butylboronic acid,1-butylboronic acid,1-butaneboronic acid,n-butaneboronic acid,boronic acid, butyl PubChem CID: 20479 IUPAC Name: butylboronic acid SMILES: B(CCCC)(O)O
| PubChem CID | 20479 |
|---|---|
| CAS | 4426-47-5 |
| Molecular Weight (g/mol) | 101.94 |
| MDL Number | MFCD00002106 |
| SMILES | B(CCCC)(O)O |
| Synonym | n-butylboronic acid,1-butylboronic acid,1-butaneboronic acid,n-butaneboronic acid,boronic acid, butyl |
| IUPAC Name | butylboronic acid |
| InChI Key | QPKFVRWIISEVCW-UHFFFAOYSA-N |
| Molecular Formula | C4H11BO2 |
(-)-Dibenzoyl-L-tartaric Acid 98.0+%, TCI America™
CAS: 2743-38-6 Molecular Formula: C18H14O8 Molecular Weight (g/mol): 358.30 MDL Number: MFCD00003074 InChI Key: YONLFQNRGZXBBF-ZIAGYGMSSA-N Synonym: dibenzoyl-l-tartaric acid,2r,3r-2,3-bis benzoyloxy succinic acid,dibenzoyltartaric acid,--dibenzoyl-l-tartaric acid,dibenzoyl-l-tartaricacid,l-dibenzoyl tartaric acid,butanedioic acid, 2,3-bis benzoyloxy-, 2r,3r,unii-3q14b666vm,2,3-bis benzoyloxy tartaric acid,o,o-dibenzoyl-+-tartaric acid PubChem CID: 75969 IUPAC Name: (2R,3R)-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 | 75969 |
|---|---|
| CAS | 2743-38-6 |
| Molecular Weight (g/mol) | 358.30 |
| MDL Number | MFCD00003074 |
| SMILES | OC(=O)[C@H](OC(=O)C1=CC=CC=C1)[C@@H](OC(=O)C1=CC=CC=C1)C(O)=O |
| Synonym | dibenzoyl-l-tartaric acid,2r,3r-2,3-bis benzoyloxy succinic acid,dibenzoyltartaric acid,--dibenzoyl-l-tartaric acid,dibenzoyl-l-tartaricacid,l-dibenzoyl tartaric acid,butanedioic acid, 2,3-bis benzoyloxy-, 2r,3r,unii-3q14b666vm,2,3-bis benzoyloxy tartaric acid,o,o-dibenzoyl-+-tartaric acid |
| IUPAC Name | (2R,3R)-2,3-bis(benzoyloxy)butanedioic acid |
| InChI Key | YONLFQNRGZXBBF-ZIAGYGMSSA-N |
| Molecular Formula | C18H14O8 |
Dicyclohexyl(trifluoromethanesulfonyloxy)borane 98.0+%, TCI America™
CAS: 145412-54-0 Molecular Formula: C13H22BF3O3S Molecular Weight (g/mol): 326.181 MDL Number: MFCD06797094 InChI Key: FBVDLYBQGQLANQ-UHFFFAOYSA-N Synonym: Dicyclohexylboron Triflate, Trifluoromethanesulfonic Acid Dicyclohexylboryl Ester PubChem CID: 10958346 IUPAC Name: dicyclohexylboranyl trifluoromethanesulfonate SMILES: B(C1CCCCC1)(C2CCCCC2)OS(=O)(=O)C(F)(F)F
| PubChem CID | 10958346 |
|---|---|
| CAS | 145412-54-0 |
| Molecular Weight (g/mol) | 326.181 |
| MDL Number | MFCD06797094 |
| SMILES | B(C1CCCCC1)(C2CCCCC2)OS(=O)(=O)C(F)(F)F |
| Synonym | Dicyclohexylboron Triflate, Trifluoromethanesulfonic Acid Dicyclohexylboryl Ester |
| IUPAC Name | dicyclohexylboranyl trifluoromethanesulfonate |
| InChI Key | FBVDLYBQGQLANQ-UHFFFAOYSA-N |
| Molecular Formula | C13H22BF3O3S |