Organic acids and derivatives
Benzyl cyanoacetate, 97%
CAS: 14447-18-8 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.19 MDL Number: MFCD00051719 InChI Key: RCUIWQWWDLZNMS-UHFFFAOYSA-N Synonym: benzyl cyanoacetate,acetic acid, cyano-, phenylmethyl ester,cyanoacetic acid benzyl ester,benzyl-cyanoacetate,acetic acid, cyano-, benzyl ester,acmc-20alph,phenylmethyl 2-cyanoacetate,cyano-acetic acid benzyl ester,benzyl ester of cyanoacetic acid PubChem CID: 560818 IUPAC Name: benzyl 2-cyanoacetate SMILES: O=C(CC#N)OCC1=CC=CC=C1
4-Pyridazinecarboxylic acid, 95%
CAS: 50681-25-9 Molecular Formula: C5H4N2O2 Molecular Weight (g/mol): 124.1 InChI Key: JUSIWJONLKBPDU-UHFFFAOYSA-N Synonym: 4-pyridazinecarboxylic acid,4-carboxypyridazine,4-pyridazinecarboxylicacid,pubchem9501,acmc-1alr8,pyridazin-4-carboxylic acid,4-pyridazine-carboxylic acid,ksc269i2f,pyridazin-4-yl formate,1,2-diazine-4-carboxylic acid PubChem CID: 2761046 IUPAC Name: pyridazine-4-carboxylic acid SMILES: C1=CN=NC=C1C(=O)O
Ethyl nonanoate, 97%
CAS: 123-29-5 Molecular Formula: C11H22O2 Molecular Weight (g/mol): 186.30 MDL Number: MFCD00009570 InChI Key: BYEVBITUADOIGY-UHFFFAOYSA-N Synonym: ethyl pelargonate,nonanoic acid, ethyl ester,ethyl nonylate,wine ether,nonanoic acid ethyl ester,natural,ethyl n-nonanoate,unii-ksh683s98j,fema no. 2447,pelargonic acid ethyl ester PubChem CID: 31251 ChEBI: CHEBI:87501 IUPAC Name: ethyl nonanoate SMILES: CCCCCCCCC(=O)OCC
Ethyl cyanoformate, 99%
CAS: 623-49-4 Molecular Formula: C4H5NO2 Molecular Weight (g/mol): 99.09 MDL Number: MFCD00001836 InChI Key: MSMGXWFHBSCQFB-UHFFFAOYSA-N Synonym: carbonocyanidic acid, ethyl ester,ethyl carbonocyanidate,2-ethoxy-2-oxoacetonitrile,cyanoformic acid ethyl ester,ethyl carbonocyanidoate,formic acid, cyano-, ethyl ester,cyanocarbonyloxyethane,ethylcyanidocarbonat,ethyl cyanoformate,ethyl cyanocarbonate PubChem CID: 69336 IUPAC Name: ethyl cyanoformate SMILES: CCOC(=O)C#N
Ethyl 3-hexenoate, 98%
CAS: 2396-83-0 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00036524 InChI Key: VTSFIPHRNAESED-AATRIKPKSA-N Synonym: ethyl 3-hexenoate,3-hexenoic acid, ethyl ester,ethyl hex-3-enoate,ethyl e-hex-3-enoate,3-hexenoic acid, ethyl ester, e,ethyl trans-3-hexenoate,ethyl e-3-hexenoate,e-3-hexenoic acid ethyl ester,ethyl hydrosorbate,3-hexenoic acid, ethyl ester, 3e PubChem CID: 5362622 IUPAC Name: ethyl (E)-hex-3-enoate SMILES: CCOC(=O)C\C=C\CC
1H-Pyrazole-3-carboxylic acid, 97%
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
Ethyl 4-hydroxy-3-methoxycinnamate, 98%
CAS: 4046-02-0 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00009190 InChI Key: ATJVZXXHKSYELS-FNORWQNLSA-N Synonym: ethyl ferulate,ferulic acid ethyl ester,ethyl 3-4-hydroxy-3-methoxyphenyl acrylate,unii-5b8915uelw,ethyl 4'-hydroxy-3'-methoxycinnamate,e-ethyl 3-4-hydroxy-3-methoxyphenyl acrylate,ethyl 2e-3-4-hydroxy-3-methoxyphenyl prop-2-enoate,ethyl 4-hydroxy-3-methoxycinnamate,e-3-4-hydroxy-3-methoxy-phenyl-acrylic acid ethyl ester,ethyl 4-hydroxy-3-methoxycinnamate ferulic acid ethyl ester PubChem CID: 736681 IUPAC Name: ethyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate SMILES: CCOC(=O)C=CC1=CC(=C(C=C1)O)OC
Methyl indole-3-carboxylate, 99%
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
Methyl 3-methylthiophene-2-carboxylate, 99%
CAS: 81452-54-2 Molecular Formula: C7H8O2S Molecular Weight (g/mol): 156.20 MDL Number: MFCD00234332 InChI Key: BRWROFVPMUPMJQ-UHFFFAOYSA-N Synonym: methyl 3-methyl-2-thiophenecarboxylate,3-methylthiophene-2-carboxylic acid methyl ester,3-methyl-thiophene-2-carboxylic acid methyl ester,2-thiophenecarboxylic acid, 3-methyl-, methyl ester,methyl 3-methyl-thiophene-2-carboxylate,d methyl ester,3-methyl-thiophene-2-carboxylic acid,pubchem10098,pubchem22915,ksc495k9b PubChem CID: 580757 IUPAC Name: methyl 3-methylthiophene-2-carboxylate SMILES: COC(=O)C1=C(C)C=CS1
3-(Trifluoromethoxy)benzeneboronic acid, 98%
CAS: 179113-90-7 Molecular Formula: C7H6BF3O3 Molecular Weight (g/mol): 205.93 MDL Number: MFCD01320697 InChI Key: UWDFWVLAHRQSKK-UHFFFAOYSA-N Synonym: 3-trifluoromethoxyphenylboronic acid,3-trifluoromethoxy phenylboronic acid,3-trifluoromethoxy phenyl boronic acid,3-trifluoromethoxy benzeneboronic acid,m-trifluoromethoxy phenylboronic acid,3-trifluoromethoxy phenyl boranediol,3-trifluoromethyloxy phenylboronic acid,boronic acid, 3-trifluoromethoxy phenyl PubChem CID: 2734385 IUPAC Name: [3-(trifluoromethoxy)phenyl]boronic acid SMILES: OB(O)C1=CC=CC(OC(F)(F)F)=C1
2-Mercaptopropionic acid, 95%
CAS: 79-42-5 Molecular Formula: C3H6O2S Molecular Weight (g/mol): 106.14 MDL Number: MFCD00004862 InChI Key: PMNLUUOXGOOLSP-UHFFFAOYNA-N Synonym: 2-mercaptopropionic acid,thiolactic acid,2-mercaptopropanoic acid,2-thiolactic acid,2-thiolpropionic acid,alpha-mercaptopropionic acid,alpha-mercaptopropanoic acid,propionic acid, 2-mercapto,propanoic acid, 2-mercapto,fema no. 3180 PubChem CID: 62326 ChEBI: CHEBI:47872 IUPAC Name: 2-sulfanylpropanoic acid SMILES: CC(S)C(O)=O
Zinc acrylate
CAS: 14643-87-9 Molecular Formula: C6H6O4Zn Molecular Weight (g/mol): 207.49 MDL Number: MFCD00067208 InChI Key: XKMZOFXGLBYJLS-UHFFFAOYSA-L Synonym: zinc acrylate,zinc diacrylate,2-propenoic acid, zinc salt,acrylic acid, zinc salt,2-propenoic acid, zinc salt 2:1,zinc prop-2-enoate,79-10-7 parent,acmc-20aj8t,dsstox_cid_7768,dsstox_rid_78559 PubChem CID: 159747 IUPAC Name: zinc;prop-2-enoate SMILES: [Zn++].[O-]C(=O)C=C.[O-]C(=O)C=C
Diethyl 1-octylphosphonate, 98%
CAS: 1068-07-1 Molecular Formula: C12H27O3P Molecular Weight (g/mol): 250.319 MDL Number: MFCD00015659 InChI Key: MVDVRXOWIPONFY-UHFFFAOYSA-N Synonym: diethyl octylphosphonate,diethyl 1-octylphosphonate,phosphonic acid, octyl-, diethyl ester,acmc-1bsbo,octylphosphonic acid diethyl ester,diethyl 1-octylphosphonate, 98+%,octyl-phosphonic acid diethyl ester,phosphonic acid,p-octyl-, diethyl ester,phosphonic acid, p-octyl-, diethyl ester PubChem CID: 70604 IUPAC Name: 1-diethoxyphosphoryloctane SMILES: CCCCCCCCP(=O)(OCC)OCC
3,3-Diethoxy-1-propylboronic acid pinacol ester, 97%, Thermo Scientific Chemicals
CAS: 165904-27-8 Molecular Formula: C13H27BO4 Molecular Weight (g/mol): 258.165 MDL Number: MFCD03788723 InChI Key: VEDSPUPKZZMMLL-UHFFFAOYSA-N Synonym: 3,3-diethoxy-1-propylboronic acid pinacol ester,2-3,3-diethoxypropyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-propanal diethyl acetal PubChem CID: 12115795 IUPAC Name: 2-(3,3-diethoxypropyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)CCC(OCC)OCC
Sodium pyruvate, MP Biomedicals™
CAS: 113-24-6 Molecular Formula: C3H3NaO3 Molecular Weight (g/mol): 110.04 MDL Number: MFCD00002586 InChI Key: DAEPDZWVDSPTHF-UHFFFAOYSA-M Synonym: Pyruvic acid sodium salt,2-Oxopropanoic acid sodium salt,α-ketopropionic acid sodium salt