Organic acids and derivatives
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1,3,5-Pentanetricarboxylic Acid 98.0+%, TCI America™
CAS: 6940-58-5 Molecular Formula: C8H12O6 Molecular Weight (g/mol): 204.18 MDL Number: MFCD00020546 InChI Key: ROTJZTYLACIJIG-UHFFFAOYSA-N PubChem CID: 96220 IUPAC Name: pentane-1,3,5-tricarboxylic acid SMILES: OC(=O)CCC(CCC(O)=O)C(O)=O
| PubChem CID | 96220 |
|---|---|
| CAS | 6940-58-5 |
| Molecular Weight (g/mol) | 204.18 |
| MDL Number | MFCD00020546 |
| SMILES | OC(=O)CCC(CCC(O)=O)C(O)=O |
| IUPAC Name | pentane-1,3,5-tricarboxylic acid |
| InChI Key | ROTJZTYLACIJIG-UHFFFAOYSA-N |
| Molecular Formula | C8H12O6 |
4-Hydroxybenzenesulfonic Acid Hydrate 85.0+%, TCI America™
CAS: 98-67-9 Molecular Formula: C6H6O4S Molecular Weight (g/mol): 174.17 MDL Number: MFCD00007506 InChI Key: FEPBITJSIHRMRT-UHFFFAOYSA-N Synonym: p-phenolsulfonic acid,phenolsulfonic acid,4-phenolsulfonic acid,p-sulfophenol,sulfocarbolic acid,benzenesulfonic acid, 4-hydroxy,p-hydroxybenzenesulfonic acid,phenol-4-sulfonic acid,benzenesulfonic acid, p-hydroxy,4-hydroxyphenylsulfonic acid PubChem CID: 4765 ChEBI: CHEBI:32354 IUPAC Name: 4-hydroxybenzene-1-sulfonic acid SMILES: OC1=CC=C(C=C1)S(O)(=O)=O
| PubChem CID | 4765 |
|---|---|
| CAS | 98-67-9 |
| Molecular Weight (g/mol) | 174.17 |
| ChEBI | CHEBI:32354 |
| MDL Number | MFCD00007506 |
| SMILES | OC1=CC=C(C=C1)S(O)(=O)=O |
| Synonym | p-phenolsulfonic acid,phenolsulfonic acid,4-phenolsulfonic acid,p-sulfophenol,sulfocarbolic acid,benzenesulfonic acid, 4-hydroxy,p-hydroxybenzenesulfonic acid,phenol-4-sulfonic acid,benzenesulfonic acid, p-hydroxy,4-hydroxyphenylsulfonic acid |
| IUPAC Name | 4-hydroxybenzene-1-sulfonic acid |
| InChI Key | FEPBITJSIHRMRT-UHFFFAOYSA-N |
| Molecular Formula | C6H6O4S |
Disodium 1-Naphthyl Phosphate Hydrate [Substrate for Phosphatase], TCI America™
CAS: 207569-06-0 Molecular Formula: C10H7Na2O4P Molecular Weight (g/mol): 268.12 MDL Number: MFCD00041007 InChI Key: QYURIFWAOPAPAJ-UHFFFAOYSA-L Synonym: 1-naphthyl phosphate disodium salt hydrate,sodium naphthalen-1-yl phosphate hydrate,disodium 1-naphthyl phosphate hydrate,disodium hydrate naphthalen-1-yl phosphate,1-naphthyl phosphate sodium salt monohydrate,c10h7o4p.2na.h2o,1-naphthyl?phosphate?disodium?salt?hydrate,1-naphthyl phosphate disodium salt monohydrate,dihydrogen naphthyl phosphate, oxamethane, sodium salt, sodium salt PubChem CID: 24212014 IUPAC Name: disodium naphthalen-1-yl phosphate SMILES: [Na+].[Na+].[O-]P([O-])(=O)OC1=C2C=CC=CC2=CC=C1
| PubChem CID | 24212014 |
|---|---|
| CAS | 207569-06-0 |
| Molecular Weight (g/mol) | 268.12 |
| MDL Number | MFCD00041007 |
| SMILES | [Na+].[Na+].[O-]P([O-])(=O)OC1=C2C=CC=CC2=CC=C1 |
| Synonym | 1-naphthyl phosphate disodium salt hydrate,sodium naphthalen-1-yl phosphate hydrate,disodium 1-naphthyl phosphate hydrate,disodium hydrate naphthalen-1-yl phosphate,1-naphthyl phosphate sodium salt monohydrate,c10h7o4p.2na.h2o,1-naphthyl?phosphate?disodium?salt?hydrate,1-naphthyl phosphate disodium salt monohydrate,dihydrogen naphthyl phosphate, oxamethane, sodium salt, sodium salt |
| IUPAC Name | disodium naphthalen-1-yl phosphate |
| InChI Key | QYURIFWAOPAPAJ-UHFFFAOYSA-L |
| Molecular Formula | C10H7Na2O4P |
4-Methyl-2-pentyl Acetate 98.0+%, TCI America™
CAS: 108-84-9 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00053723 InChI Key: CPIVYSAVIPTCCX-UHFFFAOYNA-N Synonym: Acetic Acid 1,3-Dimethylbutyl Ester, Acetic Acid 4-Methyl-2-pentyl Ester, 1,3-Dimethylbutyl Acetate PubChem CID: 7959 IUPAC Name: 4-methylpentan-2-yl acetate SMILES: CC(C)CC(C)OC(C)=O
| PubChem CID | 7959 |
|---|---|
| CAS | 108-84-9 |
| Molecular Weight (g/mol) | 144.21 |
| MDL Number | MFCD00053723 |
| SMILES | CC(C)CC(C)OC(C)=O |
| Synonym | Acetic Acid 1,3-Dimethylbutyl Ester, Acetic Acid 4-Methyl-2-pentyl Ester, 1,3-Dimethylbutyl Acetate |
| IUPAC Name | 4-methylpentan-2-yl acetate |
| InChI Key | CPIVYSAVIPTCCX-UHFFFAOYNA-N |
| Molecular Formula | C8H16O2 |
1-Methyl-4-nitro-3-propylpyrazole-5-carboxamide 96.0+%, TCI America™
CAS: 139756-01-7 Molecular Formula: C8H12N4O3 Molecular Weight (g/mol): 212.209 MDL Number: MFCD02253196 InChI Key: BMLPAJIEDKJHSB-UHFFFAOYSA-N Synonym: 5-Carbamoyl-1-methyl-4-nitro-3-propylpyrazole PubChem CID: 2754492 IUPAC Name: 2-methyl-4-nitro-5-propylpyrazole-3-carboxamide SMILES: CCCC1=NN(C(=C1[N+](=O)[O-])C(=O)N)C
| PubChem CID | 2754492 |
|---|---|
| CAS | 139756-01-7 |
| Molecular Weight (g/mol) | 212.209 |
| MDL Number | MFCD02253196 |
| SMILES | CCCC1=NN(C(=C1[N+](=O)[O-])C(=O)N)C |
| Synonym | 5-Carbamoyl-1-methyl-4-nitro-3-propylpyrazole |
| IUPAC Name | 2-methyl-4-nitro-5-propylpyrazole-3-carboxamide |
| InChI Key | BMLPAJIEDKJHSB-UHFFFAOYSA-N |
| Molecular Formula | C8H12N4O3 |
Diethyl DL-Malate 98.0+%, TCI America™
CAS: 7554-12-3 Molecular Formula: C8H14O5 Molecular Weight (g/mol): 190.20 MDL Number: MFCD00048556 InChI Key: VKNUORWMCINMRB-UHFFFAOYNA-N Synonym: DL-Apple Acid Diethyl Ester, DL-Malic Acid Diethyl Ester PubChem CID: 24197 ChEBI: CHEBI:87368 IUPAC Name: diethyl 2-hydroxybutanedioate SMILES: CCOC(=O)CC(C(=O)OCC)O
| PubChem CID | 24197 |
|---|---|
| CAS | 7554-12-3 |
| Molecular Weight (g/mol) | 190.20 |
| ChEBI | CHEBI:87368 |
| MDL Number | MFCD00048556 |
| SMILES | CCOC(=O)CC(C(=O)OCC)O |
| Synonym | DL-Apple Acid Diethyl Ester, DL-Malic Acid Diethyl Ester |
| IUPAC Name | diethyl 2-hydroxybutanedioate |
| InChI Key | VKNUORWMCINMRB-UHFFFAOYNA-N |
| Molecular Formula | C8H14O5 |
Isoamyl 4-Methoxycinnamate 95.0+%, TCI America™
CAS: 71617-10-2 Molecular Formula: C15H20O3 Molecular Weight (g/mol): 248.322 MDL Number: MFCD00583856 InChI Key: UBNYRXMKIIGMKK-RMKNXTFCSA-N Synonym: 4-Methoxycinnamic Acid Isoamyl Ester, Isopentyl 4-Methoxycinnamate, 4-Methoxycinnamic Acid Isopentyl Ester PubChem CID: 1549789 IUPAC Name: 3-methylbutyl (E)-3-(4-methoxyphenyl)prop-2-enoate SMILES: CC(C)CCOC(=O)C=CC1=CC=C(C=C1)OC
| PubChem CID | 1549789 |
|---|---|
| CAS | 71617-10-2 |
| Molecular Weight (g/mol) | 248.322 |
| MDL Number | MFCD00583856 |
| SMILES | CC(C)CCOC(=O)C=CC1=CC=C(C=C1)OC |
| Synonym | 4-Methoxycinnamic Acid Isoamyl Ester, Isopentyl 4-Methoxycinnamate, 4-Methoxycinnamic Acid Isopentyl Ester |
| IUPAC Name | 3-methylbutyl (E)-3-(4-methoxyphenyl)prop-2-enoate |
| InChI Key | UBNYRXMKIIGMKK-RMKNXTFCSA-N |
| Molecular Formula | C15H20O3 |
tert-Butyl Crotonate 98.0+%, TCI America™
CAS: 79218-15-8 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.198 MDL Number: MFCD00059055 InChI Key: QHSPZGZEUDEIQM-AATRIKPKSA-N Synonym: Crotonic Acid tert-Butyl Ester PubChem CID: 5463127 IUPAC Name: tert-butyl (E)-but-2-enoate SMILES: CC=CC(=O)OC(C)(C)C
| PubChem CID | 5463127 |
|---|---|
| CAS | 79218-15-8 |
| Molecular Weight (g/mol) | 142.198 |
| MDL Number | MFCD00059055 |
| SMILES | CC=CC(=O)OC(C)(C)C |
| Synonym | Crotonic Acid tert-Butyl Ester |
| IUPAC Name | tert-butyl (E)-but-2-enoate |
| InChI Key | QHSPZGZEUDEIQM-AATRIKPKSA-N |
| Molecular Formula | C8H14O2 |
lambda-Carrageenan (High-viscosity), TCI America™
CAS: 9064-57-7 Molecular Formula: C12H19O20S3-3 Molecular Weight (g/mol): 579.444 MDL Number: MFCD00151513 InChI Key: UWPXLSAITSWCRB-UHFFFAOYSA-K PubChem CID: 91972149 IUPAC Name: [5-[4,5-dihydroxy-6-(hydroxymethyl)-3-sulfonatooxyoxan-2-yl]oxy-2,4-dihydroxy-6-(sulfonatooxymethyl)oxan-3-yl] sulfate SMILES: C(C1C(C(C(C(O1)OC2C(OC(C(C2O)OS(=O)(=O)[O-])O)COS(=O)(=O)[O-])OS(=O)(=O)[O-])O)O)O
| PubChem CID | 91972149 |
|---|---|
| CAS | 9064-57-7 |
| Molecular Weight (g/mol) | 579.444 |
| MDL Number | MFCD00151513 |
| SMILES | C(C1C(C(C(C(O1)OC2C(OC(C(C2O)OS(=O)(=O)[O-])O)COS(=O)(=O)[O-])OS(=O)(=O)[O-])O)O)O |
| IUPAC Name | [5-[4,5-dihydroxy-6-(hydroxymethyl)-3-sulfonatooxyoxan-2-yl]oxy-2,4-dihydroxy-6-(sulfonatooxymethyl)oxan-3-yl] sulfate |
| InChI Key | UWPXLSAITSWCRB-UHFFFAOYSA-K |
| Molecular Formula | C12H19O20S3-3 |
2-Hydrogen 1-Methyl (1S,2R)-1,2,3,6-Tetrahydrophthalate 98.0+%, TCI America™
CAS: 88335-93-7 Molecular Formula: C9H12O4 Molecular Weight (g/mol): 184.19 MDL Number: MFCD00757425,MFCD00075490 InChI Key: MYYLMIDEMAPSGH-UHFFFAOYNA-N Synonym: 1s,2r-1-methyl cis-1,2,3,6-tetrahydrophthalate,1r,6s-6-methoxycarbonyl cyclohex-3-enecarboxylic acid,1r,6s-6-methoxycarbonylcyclohex-3-ene-1-carboxylic acid,1r,6s-6-methoxycarbonyl cyclohex-3-ene-1-carboxylic acid,1s,2r-1-methyl cis-4-cyclohexene-1,2-dicarboxylate,1r,6s-6-methoxycarbonyl-1-cyclohex-3-enecarboxylic acid,1s,2r-1-methylcis-1,2,3,6-tetrahydrophthalate,2-hydrogen 1-methyl 1s,2r-1,2,3,6-tetrahydrophthalate,1 r,6s-6-methoxycarbonyl-3-cyclohexene-1-carboxylic acid,1r, 2s-2-methoxycarbonylcyclohex-4-ene-1-carboxylic acid PubChem CID: 5325907 IUPAC Name: 6-(methoxycarbonyl)cyclohex-3-ene-1-carboxylic acid SMILES: COC(=O)C1CC=CCC1C(O)=O
| PubChem CID | 5325907 |
|---|---|
| CAS | 88335-93-7 |
| Molecular Weight (g/mol) | 184.19 |
| MDL Number | MFCD00757425,MFCD00075490 |
| SMILES | COC(=O)C1CC=CCC1C(O)=O |
| Synonym | 1s,2r-1-methyl cis-1,2,3,6-tetrahydrophthalate,1r,6s-6-methoxycarbonyl cyclohex-3-enecarboxylic acid,1r,6s-6-methoxycarbonylcyclohex-3-ene-1-carboxylic acid,1r,6s-6-methoxycarbonyl cyclohex-3-ene-1-carboxylic acid,1s,2r-1-methyl cis-4-cyclohexene-1,2-dicarboxylate,1r,6s-6-methoxycarbonyl-1-cyclohex-3-enecarboxylic acid,1s,2r-1-methylcis-1,2,3,6-tetrahydrophthalate,2-hydrogen 1-methyl 1s,2r-1,2,3,6-tetrahydrophthalate,1 r,6s-6-methoxycarbonyl-3-cyclohexene-1-carboxylic acid,1r, 2s-2-methoxycarbonylcyclohex-4-ene-1-carboxylic acid |
| IUPAC Name | 6-(methoxycarbonyl)cyclohex-3-ene-1-carboxylic acid |
| InChI Key | MYYLMIDEMAPSGH-UHFFFAOYNA-N |
| Molecular Formula | C9H12O4 |
Pyrazole-3-carboxylic Acid 98.0+%, TCI America™
CAS: 1621-91-6 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.09 MDL Number: MFCD00077436 InChI Key: KOPFEFZSAMLEHK-UHFFFAOYSA-N Synonym: 1h-pyrazole-3-carboxylic acid,pyrazole-3-carboxylic acid,2h-pyrazole-3-carboxylic acid,5-pyrazolecarboxylic acid,3-pyrazolecarboxylic acid,3-carboxy-1h-pyrazole,pyrazolic acid,pyrazolecarboxylic,3-carboxypyrazole,2h-pyrazole-3-carboxylicacid PubChem CID: 574310 IUPAC Name: 1H-pyrazole-5-carboxylic acid SMILES: OC(=O)C1=CC=NN1
| PubChem CID | 574310 |
|---|---|
| CAS | 1621-91-6 |
| Molecular Weight (g/mol) | 112.09 |
| MDL Number | MFCD00077436 |
| SMILES | OC(=O)C1=CC=NN1 |
| Synonym | 1h-pyrazole-3-carboxylic acid,pyrazole-3-carboxylic acid,2h-pyrazole-3-carboxylic acid,5-pyrazolecarboxylic acid,3-pyrazolecarboxylic acid,3-carboxy-1h-pyrazole,pyrazolic acid,pyrazolecarboxylic,3-carboxypyrazole,2h-pyrazole-3-carboxylicacid |
| IUPAC Name | 1H-pyrazole-5-carboxylic acid |
| InChI Key | KOPFEFZSAMLEHK-UHFFFAOYSA-N |
| Molecular Formula | C4H4N2O2 |
4-Chloroisatoic Anhydride 98.0+%, TCI America™
CAS: 40928-13-0 Molecular Formula: C8H4ClNO3 Molecular Weight (g/mol): 197.57 MDL Number: MFCD00090431 InChI Key: QRUPDIJQZCABTC-UHFFFAOYSA-N Synonym: 7-Chloro-1,2-dihydro-4H-3,1-benzoxazine-2,4-dione PubChem CID: 329105 IUPAC Name: 7-chloro-2,4-dihydro-1H-3,1-benzoxazine-2,4-dione SMILES: ClC1=CC=C2C(=O)OC(=O)NC2=C1
| PubChem CID | 329105 |
|---|---|
| CAS | 40928-13-0 |
| Molecular Weight (g/mol) | 197.57 |
| MDL Number | MFCD00090431 |
| SMILES | ClC1=CC=C2C(=O)OC(=O)NC2=C1 |
| Synonym | 7-Chloro-1,2-dihydro-4H-3,1-benzoxazine-2,4-dione |
| IUPAC Name | 7-chloro-2,4-dihydro-1H-3,1-benzoxazine-2,4-dione |
| InChI Key | QRUPDIJQZCABTC-UHFFFAOYSA-N |
| Molecular Formula | C8H4ClNO3 |
Pentabromobenzyl Acrylate 98.0+%, TCI America™
CAS: 59447-55-1 Molecular Formula: C10H5Br5O2 Molecular Weight (g/mol): 556.668 MDL Number: MFCD00804467 InChI Key: GRKDVZMVHOLESV-UHFFFAOYSA-N Synonym: Acrylic Acid Pentabromobenzyl Ester PubChem CID: 101059 IUPAC Name: (2,3,4,5,6-pentabromophenyl)methyl prop-2-enoate SMILES: C=CC(=O)OCC1=C(C(=C(C(=C1Br)Br)Br)Br)Br
| PubChem CID | 101059 |
|---|---|
| CAS | 59447-55-1 |
| Molecular Weight (g/mol) | 556.668 |
| MDL Number | MFCD00804467 |
| SMILES | C=CC(=O)OCC1=C(C(=C(C(=C1Br)Br)Br)Br)Br |
| Synonym | Acrylic Acid Pentabromobenzyl Ester |
| IUPAC Name | (2,3,4,5,6-pentabromophenyl)methyl prop-2-enoate |
| InChI Key | GRKDVZMVHOLESV-UHFFFAOYSA-N |
| Molecular Formula | C10H5Br5O2 |
Iguratimod 98.0+%, TCI America™
CAS: 123663-49-0 Molecular Formula: C17H14N2O6S Molecular Weight (g/mol): 374.367 MDL Number: MFCD00882374 InChI Key: ANMATWQYLIFGOK-UHFFFAOYSA-N Synonym: N-(3-Formamido-4-oxo-6-phenoxy-4H-chromen-7-yl)methanesulfonamide, N-[7-(Methanesulfonamido)-4-oxo-6-phenoxy-4H-chromen-3-yl]formamide PubChem CID: 124246 IUPAC Name: N-[7-(methanesulfonamido)-4-oxo-6-phenoxychromen-3-yl]formamide SMILES: CS(=O)(=O)NC1=C(C=C2C(=C1)OC=C(C2=O)NC=O)OC3=CC=CC=C3
| PubChem CID | 124246 |
|---|---|
| CAS | 123663-49-0 |
| Molecular Weight (g/mol) | 374.367 |
| MDL Number | MFCD00882374 |
| SMILES | CS(=O)(=O)NC1=C(C=C2C(=C1)OC=C(C2=O)NC=O)OC3=CC=CC=C3 |
| Synonym | N-(3-Formamido-4-oxo-6-phenoxy-4H-chromen-7-yl)methanesulfonamide, N-[7-(Methanesulfonamido)-4-oxo-6-phenoxy-4H-chromen-3-yl]formamide |
| IUPAC Name | N-[7-(methanesulfonamido)-4-oxo-6-phenoxychromen-3-yl]formamide |
| InChI Key | ANMATWQYLIFGOK-UHFFFAOYSA-N |
| Molecular Formula | C17H14N2O6S |
(S)-(+)-2,2-Dimethylcyclopropanecarboxylic Acid 98.0+%, TCI America™
CAS: 14590-53-5 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.144 MDL Number: MFCD08460918 InChI Key: BFNMOMYTTGHNGJ-SCSAIBSYSA-N PubChem CID: 10192561 IUPAC Name: (1S)-2,2-dimethylcyclopropane-1-carboxylic acid SMILES: CC1(CC1C(=O)O)C
| PubChem CID | 10192561 |
|---|---|
| CAS | 14590-53-5 |
| Molecular Weight (g/mol) | 114.144 |
| MDL Number | MFCD08460918 |
| SMILES | CC1(CC1C(=O)O)C |
| IUPAC Name | (1S)-2,2-dimethylcyclopropane-1-carboxylic acid |
| InChI Key | BFNMOMYTTGHNGJ-SCSAIBSYSA-N |
| Molecular Formula | C6H10O2 |