Organooxygen compounds
cis-4-Heptenal 95.0+%, TCI America™
CAS: 6728-31-0 Molecular Formula: C7H12O Molecular Weight (g/mol): 112.172 MDL Number: MFCD00014682 InChI Key: VVGOCOMZRGWHPI-ARJAWSKDSA-N Synonym: cis-4-heptenal,cis-4-hepten-1-al,z-hept-4-enal,z-4-heptenal,4-heptenal, z,z-4-hepten-1-al,hept-cis-4-enal,unii-5bj99wwp64,4-z-heptenal,hept-4 z-enal PubChem CID: 5362814 IUPAC Name: (Z)-hept-4-enal SMILES: CCC=CCCC=O
Hexadecanophenone 95.0+%, TCI America™
CAS: 6697-12-7 Molecular Formula: C22H36O Molecular Weight (g/mol): 316.53 MDL Number: MFCD00008997 InChI Key: IIOLAWJMOGLOIB-UHFFFAOYSA-N Synonym: Palmitophenone, Pentadecyl Phenyl Ketone PubChem CID: 81194 IUPAC Name: 1-phenylhexadecan-1-one SMILES: CCCCCCCCCCCCCCCC(=O)C1=CC=CC=C1
4'-Fluoro-3'-nitroacetophenone 98.0+%, TCI America™
CAS: 400-93-1 Molecular Formula: C8H6FNO3 Molecular Weight (g/mol): 183.138 MDL Number: MFCD00115369 InChI Key: PTCNZDJJIOLIKQ-UHFFFAOYSA-N Synonym: 4'-fluoro-3'-nitroacetophenone,1-4-fluoro-3-nitrophenyl ethanone,4-fluoro-3-nitroacetophenone,1-4-fluoro-3-nitrophenyl ethan-1-one,1-4-fluoro-3-nitro-phenyl ethanone,4-fluoro-3'-nitroacetophenone,ethanone, 1-4-fluoro-3-nitrophenyl,4-fluoro-3-nitroacetophneone,3'-nitro-4'-fluoroacetophenone PubChem CID: 2734612 IUPAC Name: 1-(4-fluoro-3-nitrophenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)F)[N+](=O)[O-]
4'-Fluoro-2'-hydroxyacetophenone 97.0+%, TCI America™
CAS: 1481-27-2 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00143203 InChI Key: HLTBTUXAMVOKIH-UHFFFAOYSA-N Synonym: 4'-fluoro-2'-hydroxyacetophenone,1-4-fluoro-2-hydroxyphenyl ethanone,4-fluoro-2-hydroxyacetophenone,1-4-fluoro-2-hydroxyphenyl ethan-1-one,ethanone, 1-4-fluoro-2-hydroxyphenyl,1-4-fluoro-2-hydroxy-phenyl ethanone,1-acetyl-4-fluoro-2-hydroxybenzene,pubchem13252,acmc-1bzss,4'-fluoro-2'-hydroxy PubChem CID: 2737326 IUPAC Name: 1-(4-fluoro-2-hydroxyphenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(F)C=C1O
4-(3-Fluorobenzyloxy)benzaldehyde 98.0+%, TCI America™
CAS: 66742-57-2 Molecular Formula: C14H11FO2 Molecular Weight (g/mol): 230.238 MDL Number: MFCD02605317 InChI Key: DNKSIIHRKWTIRH-UHFFFAOYSA-N PubChem CID: 880119 IUPAC Name: 4-[(3-fluorophenyl)methoxy]benzaldehyde SMILES: C1=CC(=CC(=C1)F)COC2=CC=C(C=C2)C=O
3-Methylcyclohexanol (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 591-23-1 Molecular Formula: C7H14O Molecular Weight (g/mol): 114.19 MDL Number: MFCD00001446 InChI Key: HTSABYAWKQAHBT-UHFFFAOYNA-N Synonym: 3-methylcyclohexanol,m-methylcyclohexanol,cyclohexanol, 3-methyl,hexahydro-m-cresol,cyclohexanol, m-methyl,3-methylcyclohexanol, mixed isomers,3-methyl-cyclohexanol,cis-3-methylcyclohexanol,trans-3-methylcyclohexanol,3-methylcyclohexanol, mixture of cis and trans PubChem CID: 11566 IUPAC Name: 3-methylcyclohexan-1-ol SMILES: CC1CCCC(O)C1
Ethyl 2-Hydroxyisobutyrate 98.0+%, TCI America™
CAS: 80-55-7 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.16 MDL Number: MFCD00004458 InChI Key: GFUIDHWFLMPAGY-UHFFFAOYSA-N Synonym: ethyl 2-hydroxyisobutyrate,ethyl 2-hydroxy-2-methylpropionate,ethyl 2-methyllactate,propanoic acid, 2-hydroxy-2-methyl-, ethyl ester,ethyl alpha-hydroxyisobutyrate,2-methyllactic acid ethyl ester,ethyl,a-hydroxyisobutyrate,lactic acid, 2-methyl-, ethyl ester,unii-s1530mcv3x,ethyl-2-hydroxyisobutyrate PubChem CID: 6653 IUPAC Name: ethyl 2-hydroxy-2-methylpropanoate SMILES: CCOC(=O)C(C)(C)O
D-Glucal 97.0+%, TCI America™
CAS: 13265-84-4 Molecular Formula: C6H10O4 Molecular Weight (g/mol): 146.142 MDL Number: MFCD00067186 InChI Key: YVECGMZCTULTIS-PBXRRBTRSA-N Synonym: d-glucal,2r,3s,4r-2-hydroxymethyl-3,4-dihydro-2h-pyran-3,4-diol,glucal,d-arabino-hex-1-enitol, 1,5-anhydro-2-deoxy,1,5-anhydro-2-deoxy-d-arabino-hex-1-enitol,dgo,pubchem10547,ksc921e7l,1,2-dideoxy-d-arabino-1-hexenopyranose PubChem CID: 2734736 IUPAC Name: (2R,3S,4R)-2-(hydroxymethyl)-3,4-dihydro-2H-pyran-3,4-diol SMILES: C1=COC(C(C1O)O)CO
4'-Hydroxy-3'-methoxyacetophenone 98.0+%, TCI America™
CAS: 498-02-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00008747 InChI Key: DFYRUELUNQRZTB-UHFFFAOYSA-N Synonym: acetovanillone,apocynin,4'-hydroxy-3'-methoxyacetophenone,1-4-hydroxy-3-methoxyphenyl ethanone,acetoguaiacone,acetoguaiacon,apocynine,4-acetyl-2-methoxyphenol,acetovanilone,acetovanyllon PubChem CID: 2214 ChEBI: CHEBI:2781 IUPAC Name: 1-(4-hydroxy-3-methoxyphenyl)ethan-1-one SMILES: COC1=CC(=CC=C1O)C(C)=O
trans-2-Hexenal 97.0+%, TCI America™
CAS: 6728-26-3 Molecular Formula: C6H10O Molecular Weight (g/mol): 98.145 MDL Number: MFCD00007008 InChI Key: MBDOYVRWFFCFHM-SNAWJCMRSA-N Synonym: trans-2-hexenal,2-hexenal,leaf aldehyde,e-2-hexenal,e-hex-2-enal,2-trans-hexenal,beta-propyl acrolein,hexylenic aldehyde,hex-2-en-1-al,2-hexenal, e PubChem CID: 5281168 ChEBI: CHEBI:28913 IUPAC Name: (E)-hex-2-enal SMILES: CCCC=CC=O
2-Ethyl-1-butanol 98.0+%, TCI America™
CAS: 97-95-0 Molecular Formula: C6H14O Molecular Weight (g/mol): 102.18 MDL Number: MFCD00004744 InChI Key: TZYRSLHNPKPEFV-UHFFFAOYSA-N Synonym: 2-ethyl-1-butanol,1-butanol, 2-ethyl,2-ethylbutanol,2-ethylbutyl alcohol,pseudohexyl alcohol,3-methylolpentane,2-ethylbutanol-1,ethylbutanol,3-pentylcarbinol,sec-pentylcarbinol PubChem CID: 7358 IUPAC Name: 2-ethylbutan-1-ol SMILES: CCC(CC)CO
1-Ethynyl-1-cyclohexanol 98.0+%, TCI America™
CAS: 78-27-3 Molecular Formula: C8H12O Molecular Weight (g/mol): 124.183 MDL Number: MFCD00003858 InChI Key: QYLFHLNFIHBCPR-UHFFFAOYSA-N Synonym: 1-ethynyl-1-cyclohexanol,1-ethynylcyclohexanol,ethynylcyclohexanol,cyclohexanol, 1-ethynyl,1-hydroxycyclohexyl ethyne,1-ethynyl-1-hydroxycyclohexane,1-ethynyl cyclohexanol,1-ethynyl-cyclohexanol,unii-6rv04025eh,1-ethynyl-cyclohexan-1-ol PubChem CID: 6525 IUPAC Name: 1-ethynylcyclohexan-1-ol SMILES: C#CC1(CCCCC1)O
5'-Fluoro-2'-hydroxyacetophenone 98.0+%, TCI America™
CAS: 394-32-1 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00011668 InChI Key: KOFFXZYMDLWRHX-UHFFFAOYSA-N Synonym: 5'-fluoro-2'-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl ethanone,1-5-fluoro-2-hydroxyphenyl ethan-1-one,5-fluoro-2-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl-1-ethanone,2-hydroxy-5-fluoroacetophenone,2'-hydroxy-5'-fluoroacetophenone,ethanone, 1-5-fluoro-2-hydroxyphenyl,5'-fluoro-2'-hydroxy acetophenone,5'-fluoro-2'-hydroxy-acetophenone PubChem CID: 95992 IUPAC Name: 1-(5-fluoro-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)F)O
Methyl (4-Fluorobenzoyl)acetate 98.0+%, TCI America™
CAS: 63131-29-3 Molecular Formula: C10H9FO3 Molecular Weight (g/mol): 196.177 MDL Number: MFCD00000355 InChI Key: HGLVYXXPRSNKQN-UHFFFAOYSA-N Synonym: methyl 4-fluorobenzoylacetate,methyl 3-4-fluorophenyl-3-oxopropanoate,methyl p-fluorobenzoylacetate,4-fluorobenzoylacetic acid methyl ester,methyl 4'-fluorobenzoylacetate,3-4-fluoro-phenyl-3-oxo-propionic acid methyl ester,benzenepropanoic acid, 4-fluoro-beta-oxo-, methyl ester,benzenepropanoic acid, 4-fluoro-.beta.-oxo-, methyl ester,pubchem16721,acmc-209nd6 PubChem CID: 579425 IUPAC Name: methyl 3-(4-fluorophenyl)-3-oxopropanoate SMILES: COC(=O)CC(=O)C1=CC=C(C=C1)F
Ethyl 1,1,2,2-Tetrafluoroethyl Ether 98.0+%, TCI America™
CAS: 512-51-6 Molecular Formula: C4H6F4O Molecular Weight (g/mol): 146.09 MDL Number: MFCD00069162 InChI Key: HBRLMDFVVMYNFH-UHFFFAOYSA-N Synonym: ethyl 1,1,2,2-tetrafluoroethyl ether,374pce-beta-gamma,1,1,2,2-tetrafluoroethyl ethyl ether,ethane, 1-ethoxy-1,1,2,2-tetrafluoro,ether, ethyl 1,1,2,2-tetrafluoroethyl,acmc-1anqb,1,1,2,2-tetrafluoroethyl ether,1,1,2,2-tetrafluoroethoxyethane,1,1,2,2-tetrafluoro ethyl ether,3-oxa-1,1,2,2-tetrafluoropentane PubChem CID: 120272 IUPAC Name: 1-ethoxy-1,1,2,2-tetrafluoroethane SMILES: CCOC(F)(F)C(F)F