Organic oxygen compounds

Alfa Aesar™ 1,4-Cyclohexanedimethanol, cis + trans, 99%

CAS: 105-08-8 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.214 MDL Number: MFCD00001512 InChI Key: YIMQCDZDWXUDCA-UHFFFAOYSA-N Synonym: 1,4-bis hydroxymethyl cyclohexane PubChem CID: 7735 IUPAC Name: [4-(hydroxymethyl)cyclohexyl]methanol SMILES: C1CC(CCC1CO)CO

Alfa Aesar™ (1,5-Cyclooctadiene)rhodium(I) 2,4-pentanedionate

CAS: 12245-39-5 Molecular Formula: C13H20O2Rh Molecular Weight (g/mol): 311.207 MDL Number: MFCD00075046 InChI Key: BUYVJWVYKPKZEX-DWVXZKBMSA-N Synonym: 3z-4-rhodiooxy pent-3-en-2-one; 1,5-cyclooctadiene, z,z PubChem CID: 10935795 IUPAC Name: (1Z,5Z)-cycloocta-1,5-diene;(Z)-4-hydroxypent-3-en-2-one;rhodium SMILES: CC(=CC(=O)C)O.C1CC=CCCC=C1.[Rh]

Alfa Aesar™ 3'-Bromopropiophenone, 97%

CAS: 19829-31-3 Molecular Formula: C9H9BrO Molecular Weight (g/mol): 213.074 MDL Number: MFCD00000084 InChI Key: QSHLXVTVXQTHBS-UHFFFAOYSA-N Synonym: 1-3-bromophenyl propan-1-one PubChem CID: 88272 IUPAC Name: 1-(3-bromophenyl)propan-1-one SMILES: CCC(=O)C1=CC(=CC=C1)Br

Alfa Aesar™ 2',3'-Difluoroacetophenone, 97%

CAS: 18355-80-1 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.132 MDL Number: MFCD00061274 InChI Key: PQUXFUBNSYCQAL-UHFFFAOYSA-N Synonym: 1-2,3-difluorophenyl ethan-1-one PubChem CID: 519550 IUPAC Name: 1-(2,3-difluorophenyl)ethanone SMILES: CC(=O)C1=C(C(=CC=C1)F)F

Alfa Aesar™ Diethyl cyclohexane-1,1-dicarboxylate, 95%

CAS: 1139-13-5 Molecular Formula: C12H20O4 Molecular Weight (g/mol): 228.288 MDL Number: MFCD02093457 InChI Key: MLHUKQNAQSRVKI-UHFFFAOYSA-N Synonym: 1,1-bis ethoxycarbonyl cyclohexane PubChem CID: 249270 IUPAC Name: diethyl cyclohexane-1,1-dicarboxylate SMILES: CCOC(=O)C1(CCCCC1)C(=O)OCC

2,6-Diacetylpyridine, 99%, ACROS Organics™

CAS: 1129-30-2 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.176 MDL Number: MFCD00006304 InChI Key: BEZVGIHGZPLGBL-UHFFFAOYSA-N Synonym: 1,1'-pyridine-2,6-diyl diethanone PubChem CID: 70790 IUPAC Name: 1-(6-acetylpyridin-2-yl)ethanone SMILES: CC(=O)C1=NC(=CC=C1)C(=O)C

Alfa Aesar™ 3'-Methoxy-5'-(trifluoromethyl)acetophenone, 97%

CAS: 916421-06-2 Molecular Formula: C10H9F3O2 Molecular Weight (g/mol): 218.175 MDL Number: MFCD09025417 InChI Key: CHTIJVBYTQACDL-UHFFFAOYSA-N Synonym: 1-3-methoxy-5-trifluoromethyl phenyl ethanone PubChem CID: 19702336 IUPAC Name: 1-[3-methoxy-5-(trifluoromethyl)phenyl]ethanone SMILES: CC(=O)C1=CC(=CC(=C1)OC)C(F)(F)F

Alfa Aesar™ 2'-Fluoro-6'-methoxyacetophenone, 98%

CAS: 120484-50-6 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.167 MDL Number: MFCD00671762 InChI Key: POHCKHGBDOTACV-UHFFFAOYSA-N Synonym: 1-2-fluoro-6-methoxy-phenyl ethanone PubChem CID: 2737355 IUPAC Name: 1-(2-fluoro-6-methoxyphenyl)ethanone SMILES: CC(=O)C1=C(C=CC=C1F)OC

3-Oxo-1-cyclopentanecarboxylic acid, 97%, ACROS Organics™

CAS: 98-78-2 Molecular Formula: C6H8O3 Molecular Weight (g/mol): 128.127 MDL Number: MFCD01320173 InChI Key: RDSNBKRWKBMPOP-UHFFFAOYSA-N Synonym: 3-carboxycyclopentanone PubChem CID: 227798 ChEBI: CHEBI:71213 IUPAC Name: 3-oxocyclopentane-1-carboxylic acid SMILES: C1CC(=O)CC1C(=O)O

Alfa Aesar™ 3',5'-Dibenzyloxyacetophenone, 98%

CAS: 28924-21-2 Molecular Formula: C22H20O3 Molecular Weight (g/mol): 332.399 MDL Number: MFCD00004777 InChI Key: KOJXGMJOTRYLBD-UHFFFAOYSA-N Synonym: 1-3,5-bis benzyloxy phenyl ethanone PubChem CID: 120098 IUPAC Name: 1-[3,5-bis(phenylmethoxy)phenyl]ethanone SMILES: CC(=O)C1=CC(=CC(=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3

Ethyl Acetoacetate, ≥99%, Alfa Aesar™

CAS: 141-97-9 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.143 MDL Number: MFCD00009199 InChI Key: XYIBRDXRRQCHLP-UHFFFAOYSA-N Synonym: 3-oxo-butyric acid ethyl ester PubChem CID: 8868 ChEBI: CHEBI:4893 IUPAC Name: ethyl 3-oxobutanoate SMILES: CCOC(=O)CC(=O)C

Alfa Aesar™ Polyvinyl alcohol, 98-99% hydrolyzed, high molecular weight

CAS: 9002-89-5 Molecular Formula: C2H4O Molecular Weight (g/mol): 44.053 MDL Number: MFCD00081922 InChI Key: IMROMDMJAWUWLK-UHFFFAOYSA-N Synonym: elvanol PubChem CID: 11199 IUPAC Name: ethenol SMILES: C=CO

Alfa Aesar™ Methyl 4-acetylbenzoate, 99%

CAS: 3609-53-8 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.187 MDL Number: MFCD00216474 InChI Key: QNTSFZXGLAHYLC-UHFFFAOYSA-N Synonym: # PubChem CID: 137990 IUPAC Name: methyl 4-acetylbenzoate SMILES: CC(=O)C1=CC=C(C=C1)C(=O)OC

Alfa Aesar™ 2-Chloro-2',4'-difluoroacetophenone, 98%

CAS: 51336-94-8 Molecular Formula: C8H5ClF2O Molecular Weight (g/mol): 190.574 MDL Number: MFCD00013252 InChI Key: UENGBOCGGKLVJJ-UHFFFAOYSA-N Synonym: 1-2,4-difluorophenyl-2-chloroethan-1-one PubChem CID: 588083 IUPAC Name: 2-chloro-1-(2,4-difluorophenyl)ethanone SMILES: C1=CC(=C(C=C1F)F)C(=O)CCl

Alfa Aesar™ 2-Butyrylfuran, 97%

CAS: 4208-57-5 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00046111 InChI Key: GONWJZJNVDRECJ-UHFFFAOYSA-N Synonym: 1-2-furanil butanone PubChem CID: 228588 IUPAC Name: 1-(furan-2-yl)butan-1-one SMILES: CCCC(=O)C1=CC=CO1

Alfa Aesar™ (R)-(-)-Mandelic acid, 98%

CAS: 611-71-2 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00064251 InChI Key: IWYDHOAUDWTVEP-SSDOTTSWSA-N Synonym: --mandelic acid PubChem CID: 11914 ChEBI: CHEBI:17656 IUPAC Name: (2R)-2-hydroxy-2-phenylacetic acid SMILES: C1=CC=C(C=C1)C(C(=O)O)O

Alfa Aesar™ 3'-Chloro-4'-fluoroacetophenone, 97%

CAS: 2923-66-2 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.583 MDL Number: MFCD00042203 InChI Key: PCJPESKRPOTNGU-UHFFFAOYSA-N Synonym: 1-3-chloro-4-fluoro-phenyl-ethanone PubChem CID: 520422 IUPAC Name: 1-(3-chloro-4-fluorophenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)F)Cl

1-Eicosanol, 98%, ACROS Organics™

CAS: 629-96-9 Molecular Formula: C20H42O Molecular Weight (g/mol): 298.555 MDL Number: MFCD00002938 InChI Key: BTFJIXJJCSYFAL-UHFFFAOYSA-N Synonym: 1-eicosanol PubChem CID: 12404 ChEBI: CHEBI:75627 IUPAC Name: icosan-1-ol SMILES: CCCCCCCCCCCCCCCCCCCCO

Alfa Aesar™ Bis(2,2,6,6-tetramethyl-3,5-heptanedionato)copper(II), 99.9% (metals basis)

CAS: 14040-05-2 Molecular Formula: C22H40CuO4 Molecular Weight (g/mol): 432.104 MDL Number: MFCD00058920 InChI Key: PEMCLTTUCGSLGJ-UHFFFAOYSA-N Synonym: 2,2,6,6-tetramethyl-5-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl oxy cuprio oxy hept-4-en-3-one PubChem CID: 91663146 IUPAC Name: copper;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one SMILES: CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.[Cu]

Alfa Aesar™ 4-Hydroxy-3-(trifluoromethoxy)benzaldehyde, 98+%

CAS: 53104-95-3 Molecular Formula: C8H5F3O3 Molecular Weight (g/mol): 206.12 MDL Number: MFCD04973780 InChI Key: GPJSLRQIOKFRFL-UHFFFAOYSA-N Synonym: 4-hydroxy-3-trifluoromethoxy benzaldehyde PubChem CID: 7018050 IUPAC Name: 4-hydroxy-3-(trifluoromethoxy)benzaldehyde SMILES: C1=CC(=C(C=C1C=O)OC(F)(F)F)O

Alfa Aesar™ cis-4-Decenal, 95%

CAS: 21662-09-9 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.253 MDL Number: MFCD00007024 InChI Key: CWRKZMLUDFBPAO-VOTSOKGWSA-N Synonym: 4-decenal PubChem CID: 5702654 IUPAC Name: (E)-dec-4-enal SMILES: CCCCCC=CCCC=O

2,6-Dimethyl-3,5-heptanedione, 99%, ACROS Organics™

CAS: 18362-64-6 Molecular Formula: C9H16O2 Molecular Weight (g/mol): 156.225 MDL Number: MFCD00015040 InChI Key: CEGGECULKVTYMM-UHFFFAOYSA-N Synonym: 2,6-dimethyl-3,5-heptandione PubChem CID: 87597 IUPAC Name: 2,6-dimethylheptane-3,5-dione SMILES: CC(C)C(=O)CC(=O)C(C)C

Alfa Aesar™ 5-Methyluridine, 99%

CAS: 1463-10-1 Molecular Formula: C10H14N2O6 Molecular Weight (g/mol): 258.23 MDL Number: MFCD00006535 InChI Key: DWRXFEITVBNRMK-JXOAFFINSA-N Synonym: 1-beta-d-ribofuranosyl thymine PubChem CID: 445408 ChEBI: CHEBI:45996 IUPAC Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione SMILES: CC1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)O

Alfa Aesar™ Tolmetin sodium salt dihydrate, 98+%

CAS: 64490-92-2 Molecular Formula: C15H18NNaO5 Molecular Weight (g/mol): 315.301 MDL Number: MFCD00150761 InChI Key: QQILXENAYPUNEA-UHFFFAOYSA-M Synonym: 1-methyl-5-p-toluoyl pyrrole-2 acetic acid PubChem CID: 23677829 ChEBI: CHEBI:72014 IUPAC Name: sodium;2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetate;dihydrate SMILES: CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC(=O)[O-].O.O.[Na+]

Alfa Aesar™ Polyphenylmethylsiloxane, MW 2500-2700

CAS: 9012-09-3 Molecular Formula: (C24H32O16)n MDL Number: MFCD00146731 InChI Key: NNLVGZFZQQXQNW-ADJNRHBOSA-N Synonym: 2r,3r,4s,5r,6s-4,5-bis acetyloxy-6-2r,3r,4s,5r,6s-4,5,6-tris acetyloxy-2-acetyloxy methyl oxan-3-yl oxy-3-2s,3r,4s,5r,6r-3,4,5-tris acetyloxy-6-acetyloxy methyl oxan-2-yl oxy oxan-2-yl methyl acetate PubChem CID: 44263853 IUPAC Name: [(2R,3R,4S,5R,6S)-4,5-diacetyloxy-3-[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-6-[(2R,3R,4S,5R,6S)-4,5,6-triacetyloxy-2-(acetyloxymethyl)oxan-3-yl]oxyoxan-2-yl]methyl acetate SMILES: CC(=O)OCC1C(C(C(C(O1)OC2C(OC(C(C2OC(=O)C)OC(=O)C)OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Alfa Aesar™ Amiodarone hydrochloride

CAS: 19774-82-4 Molecular Formula: C25H30ClI2NO3 Molecular Weight (g/mol): 681.778 MDL Number: MFCD00069204 InChI Key: ITPDYQOUSLNIHG-UHFFFAOYSA-N Synonym: amiodar PubChem CID: 441325 IUPAC Name: (2-butyl-1-benzofuran-3-yl)-[4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl]methanone;hydrochloride SMILES: CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)OCCN(CC)CC)I.Cl

Alfa Aesar™ 4-Ethynyl-2,6-dimethyl-4-heptanol, 97%

CAS: 10562-68-2 Molecular Formula: C11H20O Molecular Weight (g/mol): 168.28 MDL Number: MFCD00041605 InChI Key: CSNWKQHTZXPWJS-UHFFFAOYSA-N Synonym: 2,6-dimethyl-4-ethynyl-4-heptanol PubChem CID: 7010451 IUPAC Name: 4-ethynyl-2,6-dimethylheptan-4-ol SMILES: CC(C)CC(CC(C)C)(C#C)O

Alfa Aesar™ Tetra-n-butylammonium nitrate, 98%

CAS: 1941-27-1 Molecular Formula: C16H36N2O3 Molecular Weight (g/mol): 304.475 MDL Number: MFCD00043202 InChI Key: QHOKENWFMZXSEU-UHFFFAOYSA-N Synonym: 1-butanaminium, n,n,n-tributyl-, nitrate PubChem CID: 16027 IUPAC Name: tetrabutylazanium;nitrate SMILES: CCCC[N+](CCCC)(CCCC)CCCC.[N+](=O)([O-])[O-]

Alfa Aesar™ 1-Eicosanol, 96%

CAS: 629-96-9 Molecular Formula: C20H42O Molecular Weight (g/mol): 298.555 MDL Number: MFCD00002938 InChI Key: BTFJIXJJCSYFAL-UHFFFAOYSA-N Synonym: 1-eicosanol PubChem CID: 12404 ChEBI: CHEBI:75627 IUPAC Name: icosan-1-ol SMILES: CCCCCCCCCCCCCCCCCCCCO

1-Dimethylamino-but-1-en-3-one, 98%, ACROS Organics™

CAS: 2802-08-6 Molecular Formula: C6H11NO Molecular Weight (g/mol): 113.16 MDL Number: MFCD00142611 InChI Key: QPWSKIGAQZAJKS-SNAWJCMRSA-N Synonym: 1-dimethylamino-but-1-en-3-one PubChem CID: 5369152 IUPAC Name: (E)-4-(dimethylamino)but-3-en-2-one SMILES: CC(=O)C=CN(C)C

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