Organooxygen compounds
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4,4,5,5,6,6,7,7,7-Nonafluoro-1-heptanol 98.0+%, TCI America™
CAS: 83310-97-8 Molecular Formula: C7H7F9O Molecular Weight (g/mol): 278.12 MDL Number: MFCD02183552 InChI Key: OVBNEUIFHDEQHD-UHFFFAOYSA-N Synonym: 3-(Perfluorobutyl)propanol PubChem CID: 2779091 IUPAC Name: 4,4,5,5,6,6,7,7,7-nonafluoroheptan-1-ol SMILES: OCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F
| PubChem CID | 2779091 |
|---|---|
| CAS | 83310-97-8 |
| Molecular Weight (g/mol) | 278.12 |
| MDL Number | MFCD02183552 |
| SMILES | OCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F |
| Synonym | 3-(Perfluorobutyl)propanol |
| IUPAC Name | 4,4,5,5,6,6,7,7,7-nonafluoroheptan-1-ol |
| InChI Key | OVBNEUIFHDEQHD-UHFFFAOYSA-N |
| Molecular Formula | C7H7F9O |
Nonanal 95.0+%, TCI America™
CAS: 124-19-6 Molecular Formula: C9H18O Molecular Weight (g/mol): 142.242 MDL Number: MFCD00007030 InChI Key: GYHFUZHODSMOHU-UHFFFAOYSA-N Synonym: pelargonaldehyde,1-nonanal,nonanaldehyde,nonyl aldehyde,n-nonaldehyde,nonylic aldehyde,nonylaldehyde,nonaldehyde,n-nonanal,1-nonaldehyde PubChem CID: 31289 ChEBI: CHEBI:84268 IUPAC Name: nonanal SMILES: CCCCCCCCC=O
| PubChem CID | 31289 |
|---|---|
| CAS | 124-19-6 |
| Molecular Weight (g/mol) | 142.242 |
| ChEBI | CHEBI:84268 |
| MDL Number | MFCD00007030 |
| SMILES | CCCCCCCCC=O |
| Synonym | pelargonaldehyde,1-nonanal,nonanaldehyde,nonyl aldehyde,n-nonaldehyde,nonylic aldehyde,nonylaldehyde,nonaldehyde,n-nonanal,1-nonaldehyde |
| IUPAC Name | nonanal |
| InChI Key | GYHFUZHODSMOHU-UHFFFAOYSA-N |
| Molecular Formula | C9H18O |
2-Isobutoxynaphthalene 98.0+%, TCI America™
CAS: 2173-57-1 Molecular Formula: C14H16O Molecular Weight (g/mol): 200.28 MDL Number: MFCD00046467 InChI Key: XOHIHZHSDMWWMS-UHFFFAOYSA-N Synonym: Isobutyl 2-Naphthyl Ether PubChem CID: 16582 IUPAC Name: 2-(2-methylpropoxy)naphthalene SMILES: CC(C)COC1=CC=C2C=CC=CC2=C1
| PubChem CID | 16582 |
|---|---|
| CAS | 2173-57-1 |
| Molecular Weight (g/mol) | 200.28 |
| MDL Number | MFCD00046467 |
| SMILES | CC(C)COC1=CC=C2C=CC=CC2=C1 |
| Synonym | Isobutyl 2-Naphthyl Ether |
| IUPAC Name | 2-(2-methylpropoxy)naphthalene |
| InChI Key | XOHIHZHSDMWWMS-UHFFFAOYSA-N |
| Molecular Formula | C14H16O |
3'-Nitropropiophenone 98.0+%, TCI America™
CAS: 17408-16-1 Molecular Formula: C9H9NO3 Molecular Weight (g/mol): 179.175 MDL Number: MFCD00051516 InChI Key: VSPOTMOYDHRALZ-UHFFFAOYSA-N Synonym: 3'-nitropropiophenone,1-3-nitrophenyl propan-1-one,m-nitropropiophenone,3-nitrophenyl ethyl ketone,1-propanone, 1-3-nitrophenyl,m-nitropropio-phenone,3;-nitropropiophenone,acmc-209e7u,3-nitropropiophenone,1-3-nitrophenyl propan-l-one PubChem CID: 87096 IUPAC Name: 1-(3-nitrophenyl)propan-1-one SMILES: CCC(=O)C1=CC(=CC=C1)[N+](=O)[O-]
| PubChem CID | 87096 |
|---|---|
| CAS | 17408-16-1 |
| Molecular Weight (g/mol) | 179.175 |
| MDL Number | MFCD00051516 |
| SMILES | CCC(=O)C1=CC(=CC=C1)[N+](=O)[O-] |
| Synonym | 3'-nitropropiophenone,1-3-nitrophenyl propan-1-one,m-nitropropiophenone,3-nitrophenyl ethyl ketone,1-propanone, 1-3-nitrophenyl,m-nitropropio-phenone,3;-nitropropiophenone,acmc-209e7u,3-nitropropiophenone,1-3-nitrophenyl propan-l-one |
| IUPAC Name | 1-(3-nitrophenyl)propan-1-one |
| InChI Key | VSPOTMOYDHRALZ-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO3 |
4'-Nitrobenzo-18-crown 6-Ether 97.0+%, TCI America™
CAS: 53408-96-1 Molecular Formula: C16H23NO8 Molecular Weight (g/mol): 357.359 MDL Number: MFCD00143207 InChI Key: LQXOKBZWNFJJGI-UHFFFAOYSA-N Synonym: 4-nitrobenzo-18-crown-6,4'-nitrobenzo-18-crown 6-ether,nitrobenzo-18-crown-6,18-nitro-2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecine,20-nitro-2,5,8,11,14,17-hexaoxabicyclo 16.4.0 docosa-1 18 ,19,21-triene,4'-nitrobenzo-18-crown-6,lqxokbzwnfjjgi-uhfffaoysa,2,3-4-nitrobenzo-1,4,7,10,13,16-hexaoxacycloocta,2,3-4-nitrobenzo-1,4,7,10,13,16-hexaoxacyclooctadec-2-ene PubChem CID: 602198 IUPAC Name: 20-nitro-2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-triene SMILES: C1COCCOCCOC2=C(C=CC(=C2)[N+](=O)[O-])OCCOCCO1
| PubChem CID | 602198 |
|---|---|
| CAS | 53408-96-1 |
| Molecular Weight (g/mol) | 357.359 |
| MDL Number | MFCD00143207 |
| SMILES | C1COCCOCCOC2=C(C=CC(=C2)[N+](=O)[O-])OCCOCCO1 |
| Synonym | 4-nitrobenzo-18-crown-6,4'-nitrobenzo-18-crown 6-ether,nitrobenzo-18-crown-6,18-nitro-2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecine,20-nitro-2,5,8,11,14,17-hexaoxabicyclo 16.4.0 docosa-1 18 ,19,21-triene,4'-nitrobenzo-18-crown-6,lqxokbzwnfjjgi-uhfffaoysa,2,3-4-nitrobenzo-1,4,7,10,13,16-hexaoxacycloocta,2,3-4-nitrobenzo-1,4,7,10,13,16-hexaoxacyclooctadec-2-ene |
| IUPAC Name | 20-nitro-2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-triene |
| InChI Key | LQXOKBZWNFJJGI-UHFFFAOYSA-N |
| Molecular Formula | C16H23NO8 |
3,4-Ethylenedioxythiophene-2-carboxaldehyde 98.0+%, TCI America™
CAS: 204905-77-1 Molecular Formula: C7H6O3S Molecular Weight (g/mol): 170.182 MDL Number: MFCD01651766 InChI Key: GNVXYRDVJKJZTO-UHFFFAOYSA-N Synonym: 2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carbaldehyde,2h,3h-thieno 3,4-b 1,4 dioxine-5-carbaldehyde,3,4-ethylenedioxythiophene-2-carbaldehyde,3,4-ethylenedioxythiophene-2-carboxaldehyde,2-formyl-3,4-ethylene dioxythiophene,2h,3h-thiopheno 3,4-e 1,4-dioxane-5-carbaldehyde,2,3-dihydrothieno 3,4-b-1,4-dioxin-5-carbaldehyde,2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carboxaldehyde,thieno 3,4-b-1,4-dioxin-5-carboxaldehyde, 2,3-dihydro PubChem CID: 3540090 IUPAC Name: 2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carbaldehyde SMILES: C1COC2=C(SC=C2O1)C=O
| PubChem CID | 3540090 |
|---|---|
| CAS | 204905-77-1 |
| Molecular Weight (g/mol) | 170.182 |
| MDL Number | MFCD01651766 |
| SMILES | C1COC2=C(SC=C2O1)C=O |
| Synonym | 2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carbaldehyde,2h,3h-thieno 3,4-b 1,4 dioxine-5-carbaldehyde,3,4-ethylenedioxythiophene-2-carbaldehyde,3,4-ethylenedioxythiophene-2-carboxaldehyde,2-formyl-3,4-ethylene dioxythiophene,2h,3h-thiopheno 3,4-e 1,4-dioxane-5-carbaldehyde,2,3-dihydrothieno 3,4-b-1,4-dioxin-5-carbaldehyde,2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carboxaldehyde,thieno 3,4-b-1,4-dioxin-5-carboxaldehyde, 2,3-dihydro |
| IUPAC Name | 2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carbaldehyde |
| InChI Key | GNVXYRDVJKJZTO-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3S |
Ethyl Diformylacetate 97.0+%, TCI America™
CAS: 80370-42-9 Molecular Formula: C6H8O4 Molecular Weight (g/mol): 144.126 MDL Number: MFCD11112084 InChI Key: HMFLBGNCDZYITR-UHFFFAOYSA-N Synonym: Diformylacetic Acid Ethyl Ester, Ethyl 2-Formyl-3-oxopropionate, 2-Formyl-3-oxopropionic Acid Ethyl Ester PubChem CID: 11029955 IUPAC Name: ethyl 2-formyl-3-oxopropanoate SMILES: CCOC(=O)C(C=O)C=O
| PubChem CID | 11029955 |
|---|---|
| CAS | 80370-42-9 |
| Molecular Weight (g/mol) | 144.126 |
| MDL Number | MFCD11112084 |
| SMILES | CCOC(=O)C(C=O)C=O |
| Synonym | Diformylacetic Acid Ethyl Ester, Ethyl 2-Formyl-3-oxopropionate, 2-Formyl-3-oxopropionic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-formyl-3-oxopropanoate |
| InChI Key | HMFLBGNCDZYITR-UHFFFAOYSA-N |
| Molecular Formula | C6H8O4 |
1-Eicosanol 95.0+%, TCI America™
CAS: 629-96-9 Molecular Formula: C20H42O Molecular Weight (g/mol): 298.56 MDL Number: MFCD00002938 InChI Key: BTFJIXJJCSYFAL-UHFFFAOYSA-N Synonym: 1-eicosanol,arachidyl alcohol,n-eicosanol,arachidic alcohol,arachic alcohol,eicosyl alcohol,eicosan-1-ol,eicosanol,1-icosanol,n-1-eicosanol PubChem CID: 12404 ChEBI: CHEBI:75627 IUPAC Name: icosan-1-ol SMILES: CCCCCCCCCCCCCCCCCCCCO
| PubChem CID | 12404 |
|---|---|
| CAS | 629-96-9 |
| Molecular Weight (g/mol) | 298.56 |
| ChEBI | CHEBI:75627 |
| MDL Number | MFCD00002938 |
| SMILES | CCCCCCCCCCCCCCCCCCCCO |
| Synonym | 1-eicosanol,arachidyl alcohol,n-eicosanol,arachidic alcohol,arachic alcohol,eicosyl alcohol,eicosan-1-ol,eicosanol,1-icosanol,n-1-eicosanol |
| IUPAC Name | icosan-1-ol |
| InChI Key | BTFJIXJJCSYFAL-UHFFFAOYSA-N |
| Molecular Formula | C20H42O |
2-Ethoxypyrazine 98.0+%, TCI America™
CAS: 38028-67-0 Molecular Formula: C6H8N2O Molecular Weight (g/mol): 124.143 MDL Number: MFCD00014609 InChI Key: ATIUKJHILQVQLE-UHFFFAOYSA-N Synonym: pyrazine, ethoxy,2-ethoxy pyrazine,pyrazine, 2-ethoxy,3-ethoxypyrazine,2-ethoxy-pyrazine,acmc-1bmsg,ksc222g4b,chembl93554 PubChem CID: 2758778 IUPAC Name: 2-ethoxypyrazine SMILES: CCOC1=NC=CN=C1
| PubChem CID | 2758778 |
|---|---|
| CAS | 38028-67-0 |
| Molecular Weight (g/mol) | 124.143 |
| MDL Number | MFCD00014609 |
| SMILES | CCOC1=NC=CN=C1 |
| Synonym | pyrazine, ethoxy,2-ethoxy pyrazine,pyrazine, 2-ethoxy,3-ethoxypyrazine,2-ethoxy-pyrazine,acmc-1bmsg,ksc222g4b,chembl93554 |
| IUPAC Name | 2-ethoxypyrazine |
| InChI Key | ATIUKJHILQVQLE-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O |
Ethyl (4-Fluorobenzoyl)acetate 98.0+%, TCI America™
CAS: 1999-00-4 Molecular Formula: C11H11FO3 Molecular Weight (g/mol): 210.204 MDL Number: MFCD03093631 InChI Key: SJUXLKYJKQBZLM-UHFFFAOYSA-N Synonym: ethyl 3-4-fluorophenyl-3-oxopropanoate,ethyl 4-fluorobenzoylacetate,ethyl 4-fluorobenzoyl acetate,4-fluorobenzoylacetic acid ethyl ester,ethyl p-fluorobenzoyl acetate,4-fluorobenzoyl acetic acid ethyl ester,ethyl 3-4-fluorophenyl-3-oxopropionate,ethyl 3-4'-fluorophenyl-3-oxopropanoate,ethyl 4'-fluorobenzoylacetate,3-4-fluoro-phenyl-3-oxo-propionic acid ethyl ester PubChem CID: 2758844 IUPAC Name: ethyl 3-(4-fluorophenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC=C(C=C1)F
| PubChem CID | 2758844 |
|---|---|
| CAS | 1999-00-4 |
| Molecular Weight (g/mol) | 210.204 |
| MDL Number | MFCD03093631 |
| SMILES | CCOC(=O)CC(=O)C1=CC=C(C=C1)F |
| Synonym | ethyl 3-4-fluorophenyl-3-oxopropanoate,ethyl 4-fluorobenzoylacetate,ethyl 4-fluorobenzoyl acetate,4-fluorobenzoylacetic acid ethyl ester,ethyl p-fluorobenzoyl acetate,4-fluorobenzoyl acetic acid ethyl ester,ethyl 3-4-fluorophenyl-3-oxopropionate,ethyl 3-4'-fluorophenyl-3-oxopropanoate,ethyl 4'-fluorobenzoylacetate,3-4-fluoro-phenyl-3-oxo-propionic acid ethyl ester |
| IUPAC Name | ethyl 3-(4-fluorophenyl)-3-oxopropanoate |
| InChI Key | SJUXLKYJKQBZLM-UHFFFAOYSA-N |
| Molecular Formula | C11H11FO3 |
2-Bromo-4'-nitroacetophenone 98.0+%, TCI America™
CAS: 99-81-0 Molecular Formula: C8H6BrNO3 Molecular Weight (g/mol): 244.044 MDL Number: MFCD00007356 InChI Key: MBUPVGIGAMCMBT-UHFFFAOYSA-N Synonym: 2-bromo-4'-nitroacetophenone,2-bromo-1-4-nitrophenyl ethanone,4-nitrophenacyl bromide,p-nitrophenacyl bromide,2-bromo-1-4-nitrophenyl ethan-1-one,alpha-bromo-p-nitroacetophenone,ethanone, 2-bromo-1-4-nitrophenyl,4'-nitrophenacyl bromide,alpha-bromo-4-nitroacetophenone,2-bromo-4-nitroacetophenone PubChem CID: 66840 IUPAC Name: 2-bromo-1-(4-nitrophenyl)ethanone SMILES: C1=CC(=CC=C1C(=O)CBr)[N+](=O)[O-]
| PubChem CID | 66840 |
|---|---|
| CAS | 99-81-0 |
| Molecular Weight (g/mol) | 244.044 |
| MDL Number | MFCD00007356 |
| SMILES | C1=CC(=CC=C1C(=O)CBr)[N+](=O)[O-] |
| Synonym | 2-bromo-4'-nitroacetophenone,2-bromo-1-4-nitrophenyl ethanone,4-nitrophenacyl bromide,p-nitrophenacyl bromide,2-bromo-1-4-nitrophenyl ethan-1-one,alpha-bromo-p-nitroacetophenone,ethanone, 2-bromo-1-4-nitrophenyl,4'-nitrophenacyl bromide,alpha-bromo-4-nitroacetophenone,2-bromo-4-nitroacetophenone |
| IUPAC Name | 2-bromo-1-(4-nitrophenyl)ethanone |
| InChI Key | MBUPVGIGAMCMBT-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrNO3 |
2-Propoxynaphthalene, TCI America™
CAS: 19718-45-7 Molecular Formula: C13H14O Molecular Weight (g/mol): 186.25 MDL Number: MFCD00021610 InChI Key: UEXFDEKTELCPNF-UHFFFAOYSA-N Synonym: 2-Naphthyl Propyl Ether PubChem CID: 243587 IUPAC Name: 2-propoxynaphthalene SMILES: CCCOC1=CC=C2C=CC=CC2=C1
| PubChem CID | 243587 |
|---|---|
| CAS | 19718-45-7 |
| Molecular Weight (g/mol) | 186.25 |
| MDL Number | MFCD00021610 |
| SMILES | CCCOC1=CC=C2C=CC=CC2=C1 |
| Synonym | 2-Naphthyl Propyl Ether |
| IUPAC Name | 2-propoxynaphthalene |
| InChI Key | UEXFDEKTELCPNF-UHFFFAOYSA-N |
| Molecular Formula | C13H14O |
5-(4-Nitrophenyl)-2-furaldehyde 98.0+%, TCI America™
CAS: 7147-77-5 Molecular Formula: C11H7NO4 Molecular Weight (g/mol): 217.18 MDL Number: MFCD00124191 InChI Key: RTSOJVJDKNKNFU-UHFFFAOYSA-N Synonym: 5-4-nitrophenyl-2-furaldehyde,5-4-nitrophenyl furan-2-carbaldehyde,5-4-nitrophenyl-2-furancarboxaldehyde,5-4-nitrophenyl furfural,5-4-nitro-phenyl-furan-2-carbaldehyde,2-furancarboxaldehyde, 5-4-nitrophenyl,5-p-nitrophenyl furfural,5-4-nitrophenyl 2-furaldehyde,cambridge id 5143178,acmc-1bl92 PubChem CID: 81567 IUPAC Name: 5-(4-nitrophenyl)furan-2-carbaldehyde SMILES: C1=CC(=CC=C1C2=CC=C(O2)C=O)[N+](=O)[O-]
| PubChem CID | 81567 |
|---|---|
| CAS | 7147-77-5 |
| Molecular Weight (g/mol) | 217.18 |
| MDL Number | MFCD00124191 |
| SMILES | C1=CC(=CC=C1C2=CC=C(O2)C=O)[N+](=O)[O-] |
| Synonym | 5-4-nitrophenyl-2-furaldehyde,5-4-nitrophenyl furan-2-carbaldehyde,5-4-nitrophenyl-2-furancarboxaldehyde,5-4-nitrophenyl furfural,5-4-nitro-phenyl-furan-2-carbaldehyde,2-furancarboxaldehyde, 5-4-nitrophenyl,5-p-nitrophenyl furfural,5-4-nitrophenyl 2-furaldehyde,cambridge id 5143178,acmc-1bl92 |
| IUPAC Name | 5-(4-nitrophenyl)furan-2-carbaldehyde |
| InChI Key | RTSOJVJDKNKNFU-UHFFFAOYSA-N |
| Molecular Formula | C11H7NO4 |
4'-Nitrobiphenyl-4-carboxaldehyde 98.0+%, TCI America™
CAS: 98648-23-8 Molecular Formula: C13H9NO3 Molecular Weight (g/mol): 227.22 MDL Number: MFCD06200931 InChI Key: MGHIIGWDUVNPPV-UHFFFAOYSA-N PubChem CID: 2763586 IUPAC Name: 4'-nitro-[1,1'-biphenyl]-4-carbaldehyde SMILES: [O-][N+](=O)C1=CC=C(C=C1)C1=CC=C(C=O)C=C1
| PubChem CID | 2763586 |
|---|---|
| CAS | 98648-23-8 |
| Molecular Weight (g/mol) | 227.22 |
| MDL Number | MFCD06200931 |
| SMILES | [O-][N+](=O)C1=CC=C(C=C1)C1=CC=C(C=O)C=C1 |
| IUPAC Name | 4'-nitro-[1,1'-biphenyl]-4-carbaldehyde |
| InChI Key | MGHIIGWDUVNPPV-UHFFFAOYSA-N |
| Molecular Formula | C13H9NO3 |