Organic acids and derivatives
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1-Chloroethyl Isopropyl Carbonate 98.0+%, TCI America™
CAS: 98298-66-9 Molecular Formula: C6H11ClO3 Molecular Weight (g/mol): 166.601 MDL Number: MFCD04038100 InChI Key: XPTPAIJDVFQPJT-UHFFFAOYSA-N Synonym: Carbonic Acid 1-Chloroethyl Isopropyl Ester PubChem CID: 11789585 IUPAC Name: 1-chloroethyl propan-2-yl carbonate SMILES: CC(C)OC(=O)OC(C)Cl
| PubChem CID | 11789585 |
|---|---|
| CAS | 98298-66-9 |
| Molecular Weight (g/mol) | 166.601 |
| MDL Number | MFCD04038100 |
| SMILES | CC(C)OC(=O)OC(C)Cl |
| Synonym | Carbonic Acid 1-Chloroethyl Isopropyl Ester |
| IUPAC Name | 1-chloroethyl propan-2-yl carbonate |
| InChI Key | XPTPAIJDVFQPJT-UHFFFAOYSA-N |
| Molecular Formula | C6H11ClO3 |
AM 251 97.0+%, TCI America™
CAS: 183232-66-8 Molecular Formula: C22H21Cl2IN4O Molecular Weight (g/mol): 555.241 MDL Number: MFCD01861181 InChI Key: BUZAJRPLUGXRAB-UHFFFAOYSA-N PubChem CID: 2125 IUPAC Name: 1-(2,4-dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-piperidin-1-ylpyrazole-3-carboxamide SMILES: CC1=C(N(N=C1C(=O)NN2CCCCC2)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)I
| PubChem CID | 2125 |
|---|---|
| CAS | 183232-66-8 |
| Molecular Weight (g/mol) | 555.241 |
| MDL Number | MFCD01861181 |
| SMILES | CC1=C(N(N=C1C(=O)NN2CCCCC2)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)I |
| IUPAC Name | 1-(2,4-dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-piperidin-1-ylpyrazole-3-carboxamide |
| InChI Key | BUZAJRPLUGXRAB-UHFFFAOYSA-N |
| Molecular Formula | C22H21Cl2IN4O |
2,6-Difluoro-4-methoxyphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 406482-20-0 Molecular Formula: C7H7BF2O3 Molecular Weight (g/mol): 187.94 MDL Number: MFCD05664299 InChI Key: WVSZSFADEBGONQ-UHFFFAOYSA-N Synonym: 2,6-Difluoro-4-methoxybenzeneboronic Acid PubChem CID: 16217424 IUPAC Name: (2,6-difluoro-4-methoxyphenyl)boronic acid SMILES: COC1=CC(F)=C(B(O)O)C(F)=C1
| PubChem CID | 16217424 |
|---|---|
| CAS | 406482-20-0 |
| Molecular Weight (g/mol) | 187.94 |
| MDL Number | MFCD05664299 |
| SMILES | COC1=CC(F)=C(B(O)O)C(F)=C1 |
| Synonym | 2,6-Difluoro-4-methoxybenzeneboronic Acid |
| IUPAC Name | (2,6-difluoro-4-methoxyphenyl)boronic acid |
| InChI Key | WVSZSFADEBGONQ-UHFFFAOYSA-N |
| Molecular Formula | C7H7BF2O3 |
2-Cyanophenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 138642-62-3 Molecular Formula: C7H6BNO2 Molecular Weight (g/mol): 146.94 MDL Number: MFCD01632208 InChI Key: NPLZNDDFVCGRAG-UHFFFAOYSA-N PubChem CID: 2734610 IUPAC Name: (2-cyanophenyl)boronic acid SMILES: OB(O)C1=CC=CC=C1C#N
| PubChem CID | 2734610 |
|---|---|
| CAS | 138642-62-3 |
| Molecular Weight (g/mol) | 146.94 |
| MDL Number | MFCD01632208 |
| SMILES | OB(O)C1=CC=CC=C1C#N |
| IUPAC Name | (2-cyanophenyl)boronic acid |
| InChI Key | NPLZNDDFVCGRAG-UHFFFAOYSA-N |
| Molecular Formula | C7H6BNO2 |
Ethyl Cyclopropanecarboxylate 98.0+%, TCI America™
CAS: 4606-07-9 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00001282 InChI Key: LDDOSDVZPSGLFZ-UHFFFAOYSA-N Synonym: cyclopropanecarboxylic acid ethyl ester,ethyl cyclopropylcarboxylate,ethyl cyclopropane carboxylate,cyclopropanecarboxylic acid, ethyl ester,pubchem11840,ethyl cylopropylcarboxylate,ethoxycarbonyl cyclopropane,ethylcyclopropane carboxylate,ksc497s5p,lddosdvzpsglfz-uhfffaoysa PubChem CID: 78351 IUPAC Name: ethyl cyclopropanecarboxylate SMILES: CCOC(=O)C1CC1
| PubChem CID | 78351 |
|---|---|
| CAS | 4606-07-9 |
| Molecular Weight (g/mol) | 114.14 |
| MDL Number | MFCD00001282 |
| SMILES | CCOC(=O)C1CC1 |
| Synonym | cyclopropanecarboxylic acid ethyl ester,ethyl cyclopropylcarboxylate,ethyl cyclopropane carboxylate,cyclopropanecarboxylic acid, ethyl ester,pubchem11840,ethyl cylopropylcarboxylate,ethoxycarbonyl cyclopropane,ethylcyclopropane carboxylate,ksc497s5p,lddosdvzpsglfz-uhfffaoysa |
| IUPAC Name | ethyl cyclopropanecarboxylate |
| InChI Key | LDDOSDVZPSGLFZ-UHFFFAOYSA-N |
| Molecular Formula | C6H10O2 |
Guanidine Sulfamate 90.0+%, TCI America™
CAS: 50979-18-5 Molecular Formula: CH8N4O3S Molecular Weight (g/mol): 156.16 MDL Number: MFCD00060261 InChI Key: LNEUSAPFBRDCPM-UHFFFAOYSA-N PubChem CID: 170947 IUPAC Name: guanidine; sulfamic acid SMILES: NC(N)=N.NS(O)(=O)=O
| PubChem CID | 170947 |
|---|---|
| CAS | 50979-18-5 |
| Molecular Weight (g/mol) | 156.16 |
| MDL Number | MFCD00060261 |
| SMILES | NC(N)=N.NS(O)(=O)=O |
| IUPAC Name | guanidine; sulfamic acid |
| InChI Key | LNEUSAPFBRDCPM-UHFFFAOYSA-N |
| Molecular Formula | CH8N4O3S |
N,N-Bis(2-cyanoethyl)formamide 90.0+%, TCI America™
CAS: 3445-84-9 Molecular Formula: C7H9N3O Molecular Weight (g/mol): 151.17 MDL Number: MFCD00040894 InChI Key: MYRFNYCEQURXPT-UHFFFAOYSA-N Synonym: n,n-bis 2-cyanoethyl formamide,formamide, n,n-bis 2-cyanoethyl,3,3'-formyliminodipropiononitrile,3,3'-formylimino dipropionitrile,luprintan,acmc-1cm2w,bis 2-cyanoethyl formamide,bis 2-cyanoethyl formamide #,nn-bis 2-cyanoethyl formamide,formamide, bis 2-cyanoethyl PubChem CID: 76983 IUPAC Name: N,N-bis(2-cyanoethyl)formamide SMILES: O=CN(CCC#N)CCC#N
| PubChem CID | 76983 |
|---|---|
| CAS | 3445-84-9 |
| Molecular Weight (g/mol) | 151.17 |
| MDL Number | MFCD00040894 |
| SMILES | O=CN(CCC#N)CCC#N |
| Synonym | n,n-bis 2-cyanoethyl formamide,formamide, n,n-bis 2-cyanoethyl,3,3'-formyliminodipropiononitrile,3,3'-formylimino dipropionitrile,luprintan,acmc-1cm2w,bis 2-cyanoethyl formamide,bis 2-cyanoethyl formamide #,nn-bis 2-cyanoethyl formamide,formamide, bis 2-cyanoethyl |
| IUPAC Name | N,N-bis(2-cyanoethyl)formamide |
| InChI Key | MYRFNYCEQURXPT-UHFFFAOYSA-N |
| Molecular Formula | C7H9N3O |
1-Phenyl-1-cyclohexanecarboxylic Acid 95.0+%, TCI America™
CAS: 1135-67-7 Molecular Formula: C13H16O2 Molecular Weight (g/mol): 204.269 MDL Number: MFCD00037152 InChI Key: QXXHHHWXFHPNOS-UHFFFAOYSA-N Synonym: 1-phenylcyclohexanecarboxylic acid,1-phenyl-1-cyclohexanecarboxylic acid,1-phenyl-cyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 1-phenyl,acmc-1c6ij,1-phenylcyclohexanecarboxylicacid,qxxhhhwxfhpnos-uhfffaoysa,1-phenylcyclohexanecarboxylic acid #,cyclohexanecarboxylicacid, 1-phenyl,1-phenyl-1-cyclohexane carboxylic acid PubChem CID: 70817 IUPAC Name: 1-phenylcyclohexane-1-carboxylic acid SMILES: C1CCC(CC1)(C2=CC=CC=C2)C(=O)O
| PubChem CID | 70817 |
|---|---|
| CAS | 1135-67-7 |
| Molecular Weight (g/mol) | 204.269 |
| MDL Number | MFCD00037152 |
| SMILES | C1CCC(CC1)(C2=CC=CC=C2)C(=O)O |
| Synonym | 1-phenylcyclohexanecarboxylic acid,1-phenyl-1-cyclohexanecarboxylic acid,1-phenyl-cyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 1-phenyl,acmc-1c6ij,1-phenylcyclohexanecarboxylicacid,qxxhhhwxfhpnos-uhfffaoysa,1-phenylcyclohexanecarboxylic acid #,cyclohexanecarboxylicacid, 1-phenyl,1-phenyl-1-cyclohexane carboxylic acid |
| IUPAC Name | 1-phenylcyclohexane-1-carboxylic acid |
| InChI Key | QXXHHHWXFHPNOS-UHFFFAOYSA-N |
| Molecular Formula | C13H16O2 |
Methyl Indole-3-carboxylate 98.0+%, TCI America™
CAS: 942-24-5 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.187 MDL Number: MFCD00189407 InChI Key: QXAUTQFAWKKNLM-UHFFFAOYSA-N Synonym: methyl indole-3-carboxylate,indole-3-carboxylic acid methyl ester,methyl 3-indolecarboxylate,1h-indole-3-carboxylic acid methyl ester,1h-indole-3-carboxylic acid, methyl ester,3-carbomethoxyindole,3-methoxycarbonylindole,methylindole-3-carboxylate,indole-3-carboxylic acid, methyl ester,methyl-3-indolcarboxylate PubChem CID: 589098 ChEBI: CHEBI:65019 IUPAC Name: methyl 1H-indole-3-carboxylate SMILES: COC(=O)C1=CNC2=CC=CC=C21
| PubChem CID | 589098 |
|---|---|
| CAS | 942-24-5 |
| Molecular Weight (g/mol) | 175.187 |
| ChEBI | CHEBI:65019 |
| MDL Number | MFCD00189407 |
| SMILES | COC(=O)C1=CNC2=CC=CC=C21 |
| Synonym | methyl indole-3-carboxylate,indole-3-carboxylic acid methyl ester,methyl 3-indolecarboxylate,1h-indole-3-carboxylic acid methyl ester,1h-indole-3-carboxylic acid, methyl ester,3-carbomethoxyindole,3-methoxycarbonylindole,methylindole-3-carboxylate,indole-3-carboxylic acid, methyl ester,methyl-3-indolcarboxylate |
| IUPAC Name | methyl 1H-indole-3-carboxylate |
| InChI Key | QXAUTQFAWKKNLM-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO2 |
Dimethyl Diethylmalonate 98.0+%, TCI America™
CAS: 27132-23-6 Molecular Formula: C9H16O4 Molecular Weight (g/mol): 188.223 MDL Number: MFCD00008444 InChI Key: AYBLPISRXMEMBV-UHFFFAOYSA-N Synonym: Diethylmalonic Acid Dimethyl Ester PubChem CID: 117935 IUPAC Name: dimethyl 2,2-diethylpropanedioate SMILES: CCC(CC)(C(=O)OC)C(=O)OC
| PubChem CID | 117935 |
|---|---|
| CAS | 27132-23-6 |
| Molecular Weight (g/mol) | 188.223 |
| MDL Number | MFCD00008444 |
| SMILES | CCC(CC)(C(=O)OC)C(=O)OC |
| Synonym | Diethylmalonic Acid Dimethyl Ester |
| IUPAC Name | dimethyl 2,2-diethylpropanedioate |
| InChI Key | AYBLPISRXMEMBV-UHFFFAOYSA-N |
| Molecular Formula | C9H16O4 |
Isoindolin-1-one 98.0+%, TCI America™
CAS: 480-91-1 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD03085939 InChI Key: PXZQEOJJUGGUIB-UHFFFAOYSA-N Synonym: 2,3-Dihydro-1H-isoindol-1-one PubChem CID: 10199 ChEBI: CHEBI:74235 IUPAC Name: 2,3-dihydroisoindol-1-one SMILES: C1C2=CC=CC=C2C(=O)N1
| PubChem CID | 10199 |
|---|---|
| CAS | 480-91-1 |
| Molecular Weight (g/mol) | 133.15 |
| ChEBI | CHEBI:74235 |
| MDL Number | MFCD03085939 |
| SMILES | C1C2=CC=CC=C2C(=O)N1 |
| Synonym | 2,3-Dihydro-1H-isoindol-1-one |
| IUPAC Name | 2,3-dihydroisoindol-1-one |
| InChI Key | PXZQEOJJUGGUIB-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO |
O-[(Ethoxycarbonyl)cyanomethylenamino]-N,N,N',N'-tetramethyluronium Hexafluorophosphate 98.0+%, TCI America™
CAS: 333717-40-1 Molecular Formula: C10H17F6N4O3P Molecular Weight (g/mol): 386.235 MDL Number: MFCD01862832 InChI Key: RKTBAMPZUATMIO-JCTPKUEWSA-N Synonym: HOTU PubChem CID: 57416861 IUPAC Name: [[(Z)-(1-cyano-2-ethoxy-2-oxoethylidene)amino]oxy-(dimethylamino)methylidene]-dimethylazanium;hexafluorophosphate SMILES: CCOC(=O)C(=NOC(=[N+](C)C)N(C)C)C#N.F[P-](F)(F)(F)(F)F
| PubChem CID | 57416861 |
|---|---|
| CAS | 333717-40-1 |
| Molecular Weight (g/mol) | 386.235 |
| MDL Number | MFCD01862832 |
| SMILES | CCOC(=O)C(=NOC(=[N+](C)C)N(C)C)C#N.F[P-](F)(F)(F)(F)F |
| Synonym | HOTU |
| IUPAC Name | [[(Z)-(1-cyano-2-ethoxy-2-oxoethylidene)amino]oxy-(dimethylamino)methylidene]-dimethylazanium;hexafluorophosphate |
| InChI Key | RKTBAMPZUATMIO-JCTPKUEWSA-N |
| Molecular Formula | C10H17F6N4O3P |
Divinyl Adipate (stabilized with MEHQ) 99.0+%, TCI America™
CAS: 4074-90-2 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.22 MDL Number: MFCD00059202 InChI Key: JZQAAQZDDMEFGZ-UHFFFAOYSA-N Synonym: Adipic Acid Divinyl Ester PubChem CID: 19997 IUPAC Name: 1,6-diethenyl hexanedioate SMILES: C=COC(=O)CCCCC(=O)OC=C
| PubChem CID | 19997 |
|---|---|
| CAS | 4074-90-2 |
| Molecular Weight (g/mol) | 198.22 |
| MDL Number | MFCD00059202 |
| SMILES | C=COC(=O)CCCCC(=O)OC=C |
| Synonym | Adipic Acid Divinyl Ester |
| IUPAC Name | 1,6-diethenyl hexanedioate |
| InChI Key | JZQAAQZDDMEFGZ-UHFFFAOYSA-N |
| Molecular Formula | C10H14O4 |
Benzyl (S)-(-)-Lactate 98.0+%, TCI America™
CAS: 56777-24-3 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00209546 InChI Key: ZYTLPUIDJRKAAM-QMMMGPOBSA-N Synonym: benzyl s---lactate,benzyl l-lactate,benzyl s-lactate,s---lactic acid benzyl ester,benzyl 2s-2-hydroxypropanoate,benzyl-l-lactate,s-benzyllactate,s-benzyl lactate,s-lactic acid benzyl ester,2s-lactic acid benzyl ester PubChem CID: 11052238 IUPAC Name: benzyl (2S)-2-hydroxypropanoate SMILES: CC(C(=O)OCC1=CC=CC=C1)O
| PubChem CID | 11052238 |
|---|---|
| CAS | 56777-24-3 |
| Molecular Weight (g/mol) | 180.203 |
| MDL Number | MFCD00209546 |
| SMILES | CC(C(=O)OCC1=CC=CC=C1)O |
| Synonym | benzyl s---lactate,benzyl l-lactate,benzyl s-lactate,s---lactic acid benzyl ester,benzyl 2s-2-hydroxypropanoate,benzyl-l-lactate,s-benzyllactate,s-benzyl lactate,s-lactic acid benzyl ester,2s-lactic acid benzyl ester |
| IUPAC Name | benzyl (2S)-2-hydroxypropanoate |
| InChI Key | ZYTLPUIDJRKAAM-QMMMGPOBSA-N |
| Molecular Formula | C10H12O3 |
(R)-Propylene Carbonate 98.0+%, TCI America™
CAS: 16606-55-6 Molecular Formula: C4H6O3 Molecular Weight (g/mol): 102.089 MDL Number: MFCD00798265 InChI Key: RUOJZAUFBMNUDX-GSVOUGTGSA-N Synonym: (R)-4-Methyl-1,3-dioxolan-2-one PubChem CID: 641813 IUPAC Name: (4R)-4-methyl-1,3-dioxolan-2-one SMILES: CC1COC(=O)O1
| PubChem CID | 641813 |
|---|---|
| CAS | 16606-55-6 |
| Molecular Weight (g/mol) | 102.089 |
| MDL Number | MFCD00798265 |
| SMILES | CC1COC(=O)O1 |
| Synonym | (R)-4-Methyl-1,3-dioxolan-2-one |
| IUPAC Name | (4R)-4-methyl-1,3-dioxolan-2-one |
| InChI Key | RUOJZAUFBMNUDX-GSVOUGTGSA-N |
| Molecular Formula | C4H6O3 |