Organic acids and derivatives
4-Cyano-2-fluorophenylboronic acid, 97%
CAS: 1150114-77-4 Molecular Formula: C7H5BFNO2 Molecular Weight (g/mol): 164.93 MDL Number: MFCD07644472 InChI Key: HFAUMAIVCYTVQR-UHFFFAOYSA-N Synonym: 4-cyano-2-fluorophenyl boronic acid,boronic acid, b-4-cyano-2-fluorophenyl,acmc-2099nb,4-borono-3-fluorobenzonitrile,4-cyano-2-fluoro-phenylboronic acid,4-cyano-2-fluorobenzeneboronic acid PubChem CID: 44755209 IUPAC Name: (4-cyano-2-fluorophenyl)boronic acid SMILES: OB(O)C1=C(F)C=C(C=C1)C#N
5-Pyrimidinylboronic acid, 97%, may contain varying amounts of anhydride, Thermo Scientific Chemicals
CAS: 109299-78-7 Molecular Formula: C4H5BN2O2 Molecular Weight (g/mol): 123.91 MDL Number: MFCD03002366 InChI Key: HZFPPBMKGYINDF-UHFFFAOYSA-N Synonym: 5-pyrimidinylboronic acid,pyrimidine-5-boronic acid,5-pyrimidineboronic acid,5-pyrimidylboronic acid,pyrimidin-5-yl boronic acid,5-pyrimidine boronic acid,pyrimidinyl-5-boronic acid,pyrimidine-5-ylboronic acid,pyrimidin-5-yl-5-boronic acid,pyrimidin-5-boronic acid PubChem CID: 2795193 IUPAC Name: pyrimidin-5-ylboronic acid SMILES: OB(O)C1=CN=CN=C1
1-(4-Methylphenyl)-1-cyclopropanecarboxylic acid, 98%
CAS: 83846-66-6 Molecular Formula: C11H12O2 Molecular Weight (g/mol): 176.21 MDL Number: MFCD00066918 InChI Key: AYUGAOYMYXSOKU-UHFFFAOYSA-N Synonym: 1-p-tolyl cyclopropanecarboxylic acid,1-4-methylphenyl cyclopropanecarboxylic acid,1-4-methylphenyl-1-cyclopropanecarboxylic acid,1-4-methylphenyl cyclopropane-1-carboxylic acid,1-p-tolyl-cyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-4-methylphenyl,1-p-tolylcyclopropanecarboxylic acid,1-4-methylphenyl-1-cyclopropan carboxylic acid,cyclopropanecarboxylicacid, 1-4-methylphenyl,1-4-methylphenyl-1-cyclopropane carboxylic acid PubChem CID: 98639 IUPAC Name: 1-(4-methylphenyl)cyclopropane-1-carboxylic acid SMILES: CC1=CC=C(C=C1)C2(CC2)C(=O)O
Stearic acid hydrazide, 97%
CAS: 4130-54-5 Molecular Formula: C18H38N2O Molecular Weight (g/mol): 298.515 MDL Number: MFCD00014764 InChI Key: BYTFESSQUGDMQQ-UHFFFAOYSA-N Synonym: stearic acid hydrazide,stearic hydrazide,stearohydrazide,octadecanoic acid, hydrazide,stearoylhydrazine,stearic acid, hydrazide,unii-3fv1c68xop,3fv1c68xop,octadecanohydrazide #,stearic acid hydrazone PubChem CID: 20088 IUPAC Name: octadecanehydrazide SMILES: CCCCCCCCCCCCCCCCCC(=O)NN
Sodium n-tridecyl sulfate, 99%, may cont. up to ca 5% water and residual solvent
CAS: 3026-63-9 Molecular Formula: C13H27NaO4S Molecular Weight (g/mol): 302.405 MDL Number: MFCD00024993 InChI Key: HQCFDOOSGDZRII-UHFFFAOYSA-M Synonym: sodium tridecyl sulfate,unii-jt30s80yr4,sodium n-tridecyl sulphate,sulfuric acid, mono-c8-18-alkyl esters, sodium salts,1-tridecanol, 1-hydrogen sulfate , sodium salt 1:1,tridecyl sodium sulfate,sodium tridecyl sulphate,1-tridecanol, hydrogen sulfate, sodium salt,sodium mono-c8-18-alkyl sulfates,sodium tridecylsulfate PubChem CID: 23668353 IUPAC Name: sodium;tridecyl sulfate SMILES: CCCCCCCCCCCCCOS(=O)(=O)[O-].[Na+]
cis-Aconitic anhydride, 98%
CAS: 6318-55-4 Molecular Formula: C6H4O5 Molecular Weight (g/mol): 156.093 MDL Number: MFCD00005524 InChI Key: GVJRTUUUJYMTNQ-UHFFFAOYSA-N Synonym: cis-aconitic anhydride,aconitic anhydride,cis-aconitic acid anhydride,3-furanacetic acid, 2,5-dihydro-2,5-dioxo,2-2,5-dioxo-2,5-dihydrofuran-3-yl acetic acid,2,5-dioxofuran-3-yl acetic acid,2-2,5-dioxo-3-furyl acetic acid,1-propene-1,2,3-tricarboxylic acid, cyclic 1,2-anhydride,2,5-dioxo-2,5-dihydro-furan-3-yl-acetic acid,z-aconitic anhydride PubChem CID: 65163 IUPAC Name: 2-(2,5-dioxofuran-3-yl)acetic acid SMILES: C1=C(C(=O)OC1=O)CC(=O)O
n-Butyl propionate, 99%
CAS: 590-01-2 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.187 MDL Number: MFCD00009448 InChI Key: BTMVHUNTONAYDX-UHFFFAOYSA-N Synonym: butyl propionate,n-butyl propionate,propanoic acid, butyl ester,n-butyl propanoate,propionic acid, butyl ester,propionic acid butyl ester,unii-2nxc4ak99e,butyl propionate natural,fema no. 2211,n-butyl n-propionate PubChem CID: 11529 IUPAC Name: butyl propanoate SMILES: CCCCOC(=O)CC
1-Acetylpiperazine, 98%
CAS: 13889-98-0 MDL Number: MFCD00058676 Synonym: 1-acetylpiperazine,n-acetylpiperazine,1-piperazin-1-yl ethanone,1-piperazin-1-yl ethan-1-one,n-acetyl piperazine,acetylpiperazine,1-acetyl piperazine,piperazine, 1-acetyl,1-piperazin-1-yl-ethanone,1-piperazin-1-yl ethanon PubChem CID: 83795 IUPAC Name: 1-piperazin-1-ylethanone
Diethylenetriamine-N,N,N',N″,N″-pentaacetic acid, 90%, MP Biomedicals™
CAS: 67-43-6 Molecular Formula: C14H23N3O10 Molecular Weight (g/mol): 393.349 InChI Key: QPCDCPDFJACHGM-UHFFFAOYSA-N Synonym: pentetic acid,diethylenetriaminepentaacetic acid,dtpa,detapac,complexon v,detarex,perma kleer,titriplex v,monaquest cai,hamp-ex acid PubChem CID: 3053 ChEBI: CHEBI:35739 IUPAC Name: 2-[bis[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid SMILES: C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O
Ethyl propionate
CAS: 105-37-3 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00009308 InChI Key: FKRCODPIKNYEAC-UHFFFAOYSA-N Synonym: ethyl propionate,propanoic acid, ethyl ester,propionic ester,propionic ether,propionic acid, ethyl ester,ethylpropionate,propionate d'ethyle,propanoic acid ethyl ester,ethyl n-propionate,propionic acid ethyl ester PubChem CID: 7749 ChEBI: CHEBI:41330 IUPAC Name: ethyl propanoate SMILES: CCC(=O)OCC
5-Hydroxy-4H-chromen-4-one, 95%, Thermo Scientific™
CAS: 3952-69-0 Molecular Formula: C9H6O3 Molecular Weight (g/mol): 162.144 MDL Number: MFCD00100605 InChI Key: CJMXMDVAKVSKFI-UHFFFAOYSA-N Synonym: 5-hydroxy-4h-chromen-4-one,5-hydroxychromone,5-hydroxy-4h-1-benzopyran-4-one,5-hydroxy-chromen-4-one,4h-1-benzopyran-4-one,5-hydroxy PubChem CID: 5479462 IUPAC Name: 5-hydroxychromen-4-one SMILES: C1=CC2=C(C(=O)C=CO2)C(=C1)O
2-(1-Adamantyl)acetic acid, 97%, Thermo Scientific™
CAS: 4942-47-6 Molecular Formula: C12H17O2 Molecular Weight (g/mol): 193.27 MDL Number: MFCD00074728 InChI Key: AOTQGWFNFTVXNQ-UHFFFAOYSA-M Synonym: 1-adamantaneacetic acid,2-adamantan-1-yl acetic acid,1-adamantylacetic acid,1-adamantane acetic acid,adamantan-1-ylacetic acid,2-1-adamantyl acetic acid,tricyclo 3.3.1.13,7 dec-1-ylacetic acid,adamantan-1-yl-acetic acid,1-carboxymethyl adamantane PubChem CID: 123221 SMILES: [O-]C(=O)CC12CC3CC(CC(C3)C1)C2
2-(1H-Pyrazol-1-yl)benzoic acid, ≥97%, Thermo Scientific™
CAS: 55317-53-8 Molecular Formula: C10H8N2O2 Molecular Weight (g/mol): 188.186 MDL Number: MFCD03086184 InChI Key: MHACZVWKWUMHRR-UHFFFAOYSA-N Synonym: 2-1h-pyrazol-1-yl benzoic acid,2-1-pyrazolyl benzoic acid,2-pyrazol-1-yl benzoic acid,benzoic acid, 2-1h-pyrazol-1-yl,2-pyrazol-1-yl-benzoic acid,2-pyrazolylbenzoic acid,pubchem19561,2-1-pyrazolyl benzoicacid,benzoic acid,2-1h-pyrazol-1-yl PubChem CID: 4738383 IUPAC Name: 2-pyrazol-1-ylbenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)N2C=CC=N2
Isopropyl chloroacetate, 99%
CAS: 105-48-6 Molecular Formula: C5H9ClO2 Molecular Weight (g/mol): 136.58 MDL Number: MFCD00040410 InChI Key: VODRWDBLLGYRJT-UHFFFAOYSA-N Synonym: isopropyl chloroacetate,chloroacetic acid isopropyl ester,acetic acid, chloro-, 1-methylethyl ester,iso-propyl chloroacetate,clch2c o och ch3 2,ccris 7748,acetic acid, chloro-, isopropyl ester,acetic acid, 2-chloro-, 1-methylethyl ester,chloroacetic acid, 1-methyl ester,monochloroacetic acid isopropyl ester PubChem CID: 7759 IUPAC Name: propan-2-yl 2-chloroacetate SMILES: CC(C)OC(=O)CCl
Ethyl 2-oxo-4-phenylbutyrate, 90+%
CAS: 64920-29-2 Molecular Formula: C12H14O3 Molecular Weight (g/mol): 206.241 MDL Number: MFCD00037533 InChI Key: STPXIOGYOLJXMZ-UHFFFAOYSA-N Synonym: ethyl 2-oxo-4-phenylbutyrate,ethyl benzylpyruvate,ethyl-2-oxo-4-phenylbutyrate,unii-5ynu9lpt51,5ynu9lpt51,2-oxo-4-phenylbutyric acid ethyl ester,2-oxo-4-phenyl butyric acid ethyl ester,ethyl 2-oxo-4-phenyl-butanoate,2-oxo-4-phenylbutanoic acid ethyl ester,ethyl2-oxo-4-phenylbutyrate PubChem CID: 562087 IUPAC Name: ethyl 2-oxo-4-phenylbutanoate SMILES: CCOC(=O)C(=O)CCC1=CC=CC=C1