
Carboxylic acids and derivatives















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tert-Butyl cyanoacetate, 98%
CAS: 1116-98-9 Molecular Formula: C7H11NO2 Molecular Weight (g/mol): 141.17 MDL Number: MFCD00001938 InChI Key: BFNYNEMRWHFIMR-UHFFFAOYSA-N Synonym: tert-butyl cyanoacetate,t-butyl cyanoacetate,acetic acid, cyano-, 1,1-dimethylethyl ester,cyanoacetic acid tert-butyl ester,acetic acid, cyano-, tert-butyl ester,acetic acid, 2-cyano-, 1,1-dimethylethyl ester,tert-butylcyanacetat,t-butylcyanoacetate,tert-butylcyanoacetate,tert butyl cyanoacetate PubChem CID: 70693 IUPAC Name: tert-butyl 2-cyanoacetate SMILES: CC(C)(C)OC(=O)CC#N
PubChem CID | 70693 |
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CAS | 1116-98-9 |
Molecular Weight (g/mol) | 141.17 |
MDL Number | MFCD00001938 |
SMILES | CC(C)(C)OC(=O)CC#N |
Synonym | tert-butyl cyanoacetate,t-butyl cyanoacetate,acetic acid, cyano-, 1,1-dimethylethyl ester,cyanoacetic acid tert-butyl ester,acetic acid, cyano-, tert-butyl ester,acetic acid, 2-cyano-, 1,1-dimethylethyl ester,tert-butylcyanacetat,t-butylcyanoacetate,tert-butylcyanoacetate,tert butyl cyanoacetate |
IUPAC Name | tert-butyl 2-cyanoacetate |
InChI Key | BFNYNEMRWHFIMR-UHFFFAOYSA-N |
Molecular Formula | C7H11NO2 |
Terephthalic dihydrazide, 95%
CAS: 136-64-1 Molecular Formula: C8H10N4O2 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00014762 InChI Key: ALHNLFMSAXZKRC-UHFFFAOYSA-N Synonym: terephthalic dihydrazide,terephthalohydrazide,terephthalic acid dihydrazide,terephthalic hydrazide,1,4-benzenedicarboxylic acid, dihydrazide,terephthaloyl dihydrazide,terephthalic acid bishydrazide,terephthalic acid, dihydrazide,terephthalhydrazide,terephthalicdihydrazide PubChem CID: 67294 IUPAC Name: benzene-1,4-dicarbohydrazide SMILES: NNC(=O)C1=CC=C(C=C1)C(=O)NN
PubChem CID | 67294 |
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CAS | 136-64-1 |
Molecular Weight (g/mol) | 194.19 |
MDL Number | MFCD00014762 |
SMILES | NNC(=O)C1=CC=C(C=C1)C(=O)NN |
Synonym | terephthalic dihydrazide,terephthalohydrazide,terephthalic acid dihydrazide,terephthalic hydrazide,1,4-benzenedicarboxylic acid, dihydrazide,terephthaloyl dihydrazide,terephthalic acid bishydrazide,terephthalic acid, dihydrazide,terephthalhydrazide,terephthalicdihydrazide |
IUPAC Name | benzene-1,4-dicarbohydrazide |
InChI Key | ALHNLFMSAXZKRC-UHFFFAOYSA-N |
Molecular Formula | C8H10N4O2 |
Valeric acid hydrazide, 95%
CAS: 38291-82-6 Molecular Formula: C5H12N2O Molecular Weight (g/mol): 116.164 MDL Number: MFCD00025137 InChI Key: PJBQYCIDGYKEMN-UHFFFAOYSA-N Synonym: valeric acid hydrazide,pentanohydrazide,valerohydrazide,pentanoic acid, hydrazide,pentanoic acid hydrazide,valerylhydrazine,pentanoic acid,hydrazide,acmc-1afhr PubChem CID: 93202 IUPAC Name: pentanehydrazide SMILES: CCCCC(=O)NN
PubChem CID | 93202 |
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CAS | 38291-82-6 |
Molecular Weight (g/mol) | 116.164 |
MDL Number | MFCD00025137 |
SMILES | CCCCC(=O)NN |
Synonym | valeric acid hydrazide,pentanohydrazide,valerohydrazide,pentanoic acid, hydrazide,pentanoic acid hydrazide,valerylhydrazine,pentanoic acid,hydrazide,acmc-1afhr |
IUPAC Name | pentanehydrazide |
InChI Key | PJBQYCIDGYKEMN-UHFFFAOYSA-N |
Molecular Formula | C5H12N2O |
Ethyl cyclohexanecarboxylate, 98+%
CAS: 3289-28-9 Molecular Formula: C9H16O2 Molecular Weight (g/mol): 156.225 MDL Number: MFCD00041734 InChI Key: JJOYCHKVKWDMEA-UHFFFAOYSA-N Synonym: cyclohexanecarboxylic acid, ethyl ester,ethyl cyclohexylformate,ethyl hexahydrobenzoate,cyclohexanecarboxylic acid ethyl ester,ethoxycarbonylcyclohexane,ethyl cyclohexylcarboxylate,ethyl cyclohexanoate,fema no. 3544,ethyl cyclohexylmethanoate,ethyl cyclohexanocarboxylate PubChem CID: 18686 IUPAC Name: ethyl cyclohexanecarboxylate SMILES: CCOC(=O)C1CCCCC1
PubChem CID | 18686 |
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CAS | 3289-28-9 |
Molecular Weight (g/mol) | 156.225 |
MDL Number | MFCD00041734 |
SMILES | CCOC(=O)C1CCCCC1 |
Synonym | cyclohexanecarboxylic acid, ethyl ester,ethyl cyclohexylformate,ethyl hexahydrobenzoate,cyclohexanecarboxylic acid ethyl ester,ethoxycarbonylcyclohexane,ethyl cyclohexylcarboxylate,ethyl cyclohexanoate,fema no. 3544,ethyl cyclohexylmethanoate,ethyl cyclohexanocarboxylate |
IUPAC Name | ethyl cyclohexanecarboxylate |
InChI Key | JJOYCHKVKWDMEA-UHFFFAOYSA-N |
Molecular Formula | C9H16O2 |
N-Bromoacetamide, 95%
CAS: 79-15-2 Molecular Formula: C2H4BrNO Molecular Weight (g/mol): 137.964 MDL Number: MFCD00037097 InChI Key: VBTQNRFWXBXZQR-UHFFFAOYSA-N Synonym: acetamide, n-bromo,unii-0aq6mwh7zb,ccris 4590,0aq6mwh7zb,acetobromamide,n-bromo-acetamide,sjyhiabiktp@,acmc-209pgg,n-bromoacetamide, powder,lopac-b-2377 PubChem CID: 4353 IUPAC Name: N-bromoacetamide SMILES: CC(=O)NBr
PubChem CID | 4353 |
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CAS | 79-15-2 |
Molecular Weight (g/mol) | 137.964 |
MDL Number | MFCD00037097 |
SMILES | CC(=O)NBr |
Synonym | acetamide, n-bromo,unii-0aq6mwh7zb,ccris 4590,0aq6mwh7zb,acetobromamide,n-bromo-acetamide,sjyhiabiktp@,acmc-209pgg,n-bromoacetamide, powder,lopac-b-2377 |
IUPAC Name | N-bromoacetamide |
InChI Key | VBTQNRFWXBXZQR-UHFFFAOYSA-N |
Molecular Formula | C2H4BrNO |
N,N-Diethylformamide, 99%
CAS: 617-84-5 Molecular Formula: C5H11NO Molecular Weight (g/mol): 101.15 MDL Number: MFCD00003287 InChI Key: SUAKHGWARZSWIH-UHFFFAOYSA-N Synonym: diethylformamide,formamide, n,n-diethyl,n-formyldiethylamine,diethyl formamide,formyldiethylamine,diethylamid kyseliny mravenci,n,n-diethylcarboxamide,diethylamid kyseliny mravenci czech,diethyl-formamide,formamide, diethyl PubChem CID: 12051 IUPAC Name: N,N-diethylformamide SMILES: CCN(CC)C=O
PubChem CID | 12051 |
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CAS | 617-84-5 |
Molecular Weight (g/mol) | 101.15 |
MDL Number | MFCD00003287 |
SMILES | CCN(CC)C=O |
Synonym | diethylformamide,formamide, n,n-diethyl,n-formyldiethylamine,diethyl formamide,formyldiethylamine,diethylamid kyseliny mravenci,n,n-diethylcarboxamide,diethylamid kyseliny mravenci czech,diethyl-formamide,formamide, diethyl |
IUPAC Name | N,N-diethylformamide |
InChI Key | SUAKHGWARZSWIH-UHFFFAOYSA-N |
Molecular Formula | C5H11NO |
Triethyl 1,1,2-ethanetricarboxylate, 99%
CAS: 7459-46-3 MDL Number: MFCD00009154 InChI Key: TVWZLLYAJDSSCJ-UHFFFAOYSA-N Synonym: triethyl 1,1,2-ethanetricarboxylate,1,1,2-ethanetricarboxylic acid, triethyl ester,2-ethoxycarbonyl-succinic acid diethyl ester,triethyl ethane tricarboxylate,1,1,2-triethyl ethane-1,1,2-tricarboxylate,triethyl ethane-1,2,2-tricarboxylate,ethane-1,1,2-tricarboxylic acid triethyl ester,ethane-1,1,2-tricarboxylic acid, triethyl ester,diethyl 2-ethoxycarbonyl butane-1,4-dioate,acmc-209ovd PubChem CID: 81961 IUPAC Name: triethyl ethane-1,1,2-tricarboxylate SMILES: CCOC(=O)CC(C(=O)OCC)C(=O)OCC
PubChem CID | 81961 |
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CAS | 7459-46-3 |
MDL Number | MFCD00009154 |
SMILES | CCOC(=O)CC(C(=O)OCC)C(=O)OCC |
Synonym | triethyl 1,1,2-ethanetricarboxylate,1,1,2-ethanetricarboxylic acid, triethyl ester,2-ethoxycarbonyl-succinic acid diethyl ester,triethyl ethane tricarboxylate,1,1,2-triethyl ethane-1,1,2-tricarboxylate,triethyl ethane-1,2,2-tricarboxylate,ethane-1,1,2-tricarboxylic acid triethyl ester,ethane-1,1,2-tricarboxylic acid, triethyl ester,diethyl 2-ethoxycarbonyl butane-1,4-dioate,acmc-209ovd |
IUPAC Name | triethyl ethane-1,1,2-tricarboxylate |
InChI Key | TVWZLLYAJDSSCJ-UHFFFAOYSA-N |
Trimethylacetamide, 98%
CAS: 754-10-9 Molecular Formula: C5H11NO Molecular Weight (g/mol): 101.15 MDL Number: MFCD00008011 InChI Key: XIPFMBOWZXULIA-UHFFFAOYSA-N Synonym: pivalamide,trimethylacetamide,2,2,2-trimethylacetamide,propanamide, 2,2-dimethyl,2,2-dimethylpropionamide,2,2-dimethyl-propionamide,unii-fes86mr7zi,fes86mr7zi,propanamide,2,2-dimethyl,trimethylacetarnide PubChem CID: 12957 IUPAC Name: 2,2-dimethylpropanamide SMILES: CC(C)(C)C(N)=O
PubChem CID | 12957 |
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CAS | 754-10-9 |
Molecular Weight (g/mol) | 101.15 |
MDL Number | MFCD00008011 |
SMILES | CC(C)(C)C(N)=O |
Synonym | pivalamide,trimethylacetamide,2,2,2-trimethylacetamide,propanamide, 2,2-dimethyl,2,2-dimethylpropionamide,2,2-dimethyl-propionamide,unii-fes86mr7zi,fes86mr7zi,propanamide,2,2-dimethyl,trimethylacetarnide |
IUPAC Name | 2,2-dimethylpropanamide |
InChI Key | XIPFMBOWZXULIA-UHFFFAOYSA-N |
Molecular Formula | C5H11NO |
N,N-Diethylnicotinamide, 97%
CAS: 59-26-7 Molecular Formula: C10H14N2O Molecular Weight (g/mol): 178.23 MDL Number: MFCD00006386 InChI Key: NCYVXEGFNDZQCU-UHFFFAOYSA-N Synonym: nikethamide,n,n-diethylnicotinamide,nicethamide,corvin,anacardone,anacordone,carbamidal,coramine,corvotone,nicamide PubChem CID: 5497 IUPAC Name: N,N-diethylpyridine-3-carboxamide SMILES: CCN(CC)C(=O)C1=CN=CC=C1
PubChem CID | 5497 |
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CAS | 59-26-7 |
Molecular Weight (g/mol) | 178.23 |
MDL Number | MFCD00006386 |
SMILES | CCN(CC)C(=O)C1=CN=CC=C1 |
Synonym | nikethamide,n,n-diethylnicotinamide,nicethamide,corvin,anacardone,anacordone,carbamidal,coramine,corvotone,nicamide |
IUPAC Name | N,N-diethylpyridine-3-carboxamide |
InChI Key | NCYVXEGFNDZQCU-UHFFFAOYSA-N |
Molecular Formula | C10H14N2O |
Tetramethylammonium formate, 30% w/w aq. soln.
CAS: 59138-84-0 Molecular Formula: C5H13NO2 Molecular Weight (g/mol): 119.16 MDL Number: MFCD00054402 InChI Key: WWIYWFVQZQOECA-UHFFFAOYSA-M Synonym: tetramethylammonium formate,fibrogenina,forgenin,tonoformina,methanaminium, n,n,n-trimethyl-, formate,tetramethylazanium formate,n,n,n-trimethylmethanaminium formate,ammonium, tetramethyl-, formate,methanaminium, n,n,n-trimethyl-, formate 1:1,c4h12n.cho2 PubChem CID: 42961 IUPAC Name: tetramethylazanium;formate SMILES: [O-]C=O.C[N+](C)(C)C
PubChem CID | 42961 |
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CAS | 59138-84-0 |
Molecular Weight (g/mol) | 119.16 |
MDL Number | MFCD00054402 |
SMILES | [O-]C=O.C[N+](C)(C)C |
Synonym | tetramethylammonium formate,fibrogenina,forgenin,tonoformina,methanaminium, n,n,n-trimethyl-, formate,tetramethylazanium formate,n,n,n-trimethylmethanaminium formate,ammonium, tetramethyl-, formate,methanaminium, n,n,n-trimethyl-, formate 1:1,c4h12n.cho2 |
IUPAC Name | tetramethylazanium;formate |
InChI Key | WWIYWFVQZQOECA-UHFFFAOYSA-M |
Molecular Formula | C5H13NO2 |
Lithium isobutyrate, 98+%
CAS: 25179-23-1 Molecular Formula: C4H7LiO2 Molecular Weight (g/mol): 94.038 MDL Number: MFCD00210622 InChI Key: IIDVGIFOWJJSIJ-UHFFFAOYSA-M Synonym: lithium isobutyrate,lithium 2-methylpropanoate,acmc-1ccd2,isobutyric acid lithium salt,lithium 1+ isobutyrate,lithium 1+ ion isobutyrate PubChem CID: 23665557 IUPAC Name: lithium;2-methylpropanoate SMILES: [Li+].CC(C)C(=O)[O-]
PubChem CID | 23665557 |
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CAS | 25179-23-1 |
Molecular Weight (g/mol) | 94.038 |
MDL Number | MFCD00210622 |
SMILES | [Li+].CC(C)C(=O)[O-] |
Synonym | lithium isobutyrate,lithium 2-methylpropanoate,acmc-1ccd2,isobutyric acid lithium salt,lithium 1+ isobutyrate,lithium 1+ ion isobutyrate |
IUPAC Name | lithium;2-methylpropanoate |
InChI Key | IIDVGIFOWJJSIJ-UHFFFAOYSA-M |
Molecular Formula | C4H7LiO2 |
Methyl 3-(2-morpholin-4-ylethoxy)benzoate, 97%, Thermo Scientific™
CAS: 249937-00-6 Molecular Formula: C14H19NO4 Molecular Weight (g/mol): 265.31 MDL Number: MFCD08060518 InChI Key: VOYSHDFODOJUMP-UHFFFAOYSA-N Synonym: methyl 3-2-morpholin-4-ylethoxy benzoate,methyl 3-2-morpholin-4-yl ethoxy benzoate,methyl 3-2-morpholinoethoxy benzoate,methyl 3-2-morpholin4-ylethoxy benzoate,3-2-morpholin-4-yl-ethoxy-benzoic acid methyl ester,benzoic acid,3-2-4-morpholinyl ethoxy-, methyl ester PubChem CID: 7164628 IUPAC Name: methyl 3-(2-morpholin-4-ylethoxy)benzoate SMILES: COC(=O)C1=CC(OCCN2CCOCC2)=CC=C1
PubChem CID | 7164628 |
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CAS | 249937-00-6 |
Molecular Weight (g/mol) | 265.31 |
MDL Number | MFCD08060518 |
SMILES | COC(=O)C1=CC(OCCN2CCOCC2)=CC=C1 |
Synonym | methyl 3-2-morpholin-4-ylethoxy benzoate,methyl 3-2-morpholin-4-yl ethoxy benzoate,methyl 3-2-morpholinoethoxy benzoate,methyl 3-2-morpholin4-ylethoxy benzoate,3-2-morpholin-4-yl-ethoxy-benzoic acid methyl ester,benzoic acid,3-2-4-morpholinyl ethoxy-, methyl ester |
IUPAC Name | methyl 3-(2-morpholin-4-ylethoxy)benzoate |
InChI Key | VOYSHDFODOJUMP-UHFFFAOYSA-N |
Molecular Formula | C14H19NO4 |
1-Methyl-1H-pyrazole-3-carboxylic acid, 95%, Thermo Scientific™
CAS: 25016-20-0 Molecular Formula: C5H6N2O2 Molecular Weight (g/mol): 126.12 MDL Number: MFCD00464254 InChI Key: YBFIKNNFQIBIQZ-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-3-carboxylic acid,1h-pyrazole-3-carboxylic acid, 1-methyl,3-carboxy-1-methyl-1h-pyrazole,zlchem 1152,acmc-209ggi,1-methylpyrazolecarboxylic acid,1-methyl-pyrazole-3-carboxylic acid,pyrazole-3-carboxylic acid, 1-methyl,1h-pyrazole-3-carboxylicacid, 1-methyl,1-methyl-1h-4-pyrazole-3-carboxylic acid PubChem CID: 573176 ChEBI: CHEBI:74738 IUPAC Name: 1-methylpyrazole-3-carboxylic acid SMILES: CN1C=CC(=N1)C(O)=O
PubChem CID | 573176 |
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CAS | 25016-20-0 |
Molecular Weight (g/mol) | 126.12 |
ChEBI | CHEBI:74738 |
MDL Number | MFCD00464254 |
SMILES | CN1C=CC(=N1)C(O)=O |
Synonym | 1-methyl-1h-pyrazole-3-carboxylic acid,1h-pyrazole-3-carboxylic acid, 1-methyl,3-carboxy-1-methyl-1h-pyrazole,zlchem 1152,acmc-209ggi,1-methylpyrazolecarboxylic acid,1-methyl-pyrazole-3-carboxylic acid,pyrazole-3-carboxylic acid, 1-methyl,1h-pyrazole-3-carboxylicacid, 1-methyl,1-methyl-1h-4-pyrazole-3-carboxylic acid |
IUPAC Name | 1-methylpyrazole-3-carboxylic acid |
InChI Key | YBFIKNNFQIBIQZ-UHFFFAOYSA-N |
Molecular Formula | C5H6N2O2 |
Methyl 3-[3-(dimethylamino)propoxy]benzoate, 97%, Thermo Scientific™
CAS: 921938-75-2 Molecular Formula: C13H19NO3 Molecular Weight (g/mol): 237.299 MDL Number: MFCD09702393 InChI Key: WGAZXKVAWOAUOI-UHFFFAOYSA-N Synonym: methyl 3-3-dimethylamino propoxy benzoate PubChem CID: 24229605 IUPAC Name: methyl 3-[3-(dimethylamino)propoxy]benzoate SMILES: CN(C)CCCOC1=CC=CC(=C1)C(=O)OC
PubChem CID | 24229605 |
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CAS | 921938-75-2 |
Molecular Weight (g/mol) | 237.299 |
MDL Number | MFCD09702393 |
SMILES | CN(C)CCCOC1=CC=CC(=C1)C(=O)OC |
Synonym | methyl 3-3-dimethylamino propoxy benzoate |
IUPAC Name | methyl 3-[3-(dimethylamino)propoxy]benzoate |
InChI Key | WGAZXKVAWOAUOI-UHFFFAOYSA-N |
Molecular Formula | C13H19NO3 |
Potassium formate, 96%, pract.
CAS: 590-29-4 Molecular Formula: CHKO2 Molecular Weight (g/mol): 84.12 MDL Number: MFCD00013100 InChI Key: WFIZEGIEIOHZCP-UHFFFAOYSA-M Synonym: potassium formate,formic acid potassium salt,formic acid, potassium salt,formic acid, k salt,hcook,mravencan draselny czech,hco2k,formic acid, potassium salt 1:1,potassium formira,64-18-6 parent PubChem CID: 2735122 ChEBI: CHEBI:63316 IUPAC Name: potassium;formate SMILES: C(=O)[O-].[K+]
PubChem CID | 2735122 |
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CAS | 590-29-4 |
Molecular Weight (g/mol) | 84.12 |
ChEBI | CHEBI:63316 |
MDL Number | MFCD00013100 |
SMILES | C(=O)[O-].[K+] |
Synonym | potassium formate,formic acid potassium salt,formic acid, potassium salt,formic acid, k salt,hcook,mravencan draselny czech,hco2k,formic acid, potassium salt 1:1,potassium formira,64-18-6 parent |
IUPAC Name | potassium;formate |
InChI Key | WFIZEGIEIOHZCP-UHFFFAOYSA-M |
Molecular Formula | CHKO2 |