Organooxygen compounds
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3-Chlorobenzoylacetonitrile, 98%
CAS: 21667-62-9 Molecular Formula: C9H6ClNO Molecular Weight (g/mol): 179.60 MDL Number: MFCD00067891 InChI Key: IUDFNNHFARLIPF-UHFFFAOYSA-N Synonym: 3-chlorobenzoylacetonitrile,3-3-chlorophenyl-3-oxopropanenitrile,3-chlorophenacylcyanide,3-chlorobenzoyl acetonitrile,3-3-chlorophenyl-3-oxo-propanenitrile,beta-ketonitrile 5b,pubchem12046,m-chlorophenacyl cyanide,acmc-1cqmb,maybridge1_004670 PubChem CID: 140855 IUPAC Name: 3-(3-chlorophenyl)-3-oxopropanenitrile SMILES: ClC1=CC=CC(=C1)C(=O)CC#N
| PubChem CID | 140855 |
|---|---|
| CAS | 21667-62-9 |
| Molecular Weight (g/mol) | 179.60 |
| MDL Number | MFCD00067891 |
| SMILES | ClC1=CC=CC(=C1)C(=O)CC#N |
| Synonym | 3-chlorobenzoylacetonitrile,3-3-chlorophenyl-3-oxopropanenitrile,3-chlorophenacylcyanide,3-chlorobenzoyl acetonitrile,3-3-chlorophenyl-3-oxo-propanenitrile,beta-ketonitrile 5b,pubchem12046,m-chlorophenacyl cyanide,acmc-1cqmb,maybridge1_004670 |
| IUPAC Name | 3-(3-chlorophenyl)-3-oxopropanenitrile |
| InChI Key | IUDFNNHFARLIPF-UHFFFAOYSA-N |
| Molecular Formula | C9H6ClNO |
4-Nitrobenzo-18-crown-6, 99%
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 |
2-Chloroethyl methyl ether, 98%
CAS: 627-42-9 Molecular Formula: C3H7ClO Molecular Weight (g/mol): 94.54 MDL Number: MFCD00000972 InChI Key: XTIGGAHUZJWQMD-UHFFFAOYSA-N Synonym: 2-chloroethyl methyl ether,2-methoxyethyl chloride,ethane, 1-chloro-2-methoxy,2-chloroethylmethylether,unii-u890tj10ym,chloro-2-methoxyethane,chloroethyl-methyl ether,1-chloro-2-methoxy-ethane,ether, 2-chloroethyl methyl PubChem CID: 12316 IUPAC Name: 1-chloro-2-methoxyethane SMILES: COCCCl
| PubChem CID | 12316 |
|---|---|
| CAS | 627-42-9 |
| Molecular Weight (g/mol) | 94.54 |
| MDL Number | MFCD00000972 |
| SMILES | COCCCl |
| Synonym | 2-chloroethyl methyl ether,2-methoxyethyl chloride,ethane, 1-chloro-2-methoxy,2-chloroethylmethylether,unii-u890tj10ym,chloro-2-methoxyethane,chloroethyl-methyl ether,1-chloro-2-methoxy-ethane,ether, 2-chloroethyl methyl |
| IUPAC Name | 1-chloro-2-methoxyethane |
| InChI Key | XTIGGAHUZJWQMD-UHFFFAOYSA-N |
| Molecular Formula | C3H7ClO |
1,1,3-Trimethoxypropane, 97%
CAS: 14315-97-0 Molecular Formula: C6H14O3 Molecular Weight (g/mol): 134.18 MDL Number: MFCD00008490 InChI Key: FKZYYYDRLJCHGL-UHFFFAOYSA-N Synonym: propane, 1,1,3-trimethoxy,propane,1,1,3-trimethoxy,acmc-1brb6,1,1,3-trimethoxy-propane,1,1,3-trimethoxypropane,beta-methoxypropionaldehyde dimethyl acetal PubChem CID: 84348 IUPAC Name: 1,1,3-trimethoxypropane SMILES: COCCC(OC)OC
| PubChem CID | 84348 |
|---|---|
| CAS | 14315-97-0 |
| Molecular Weight (g/mol) | 134.18 |
| MDL Number | MFCD00008490 |
| SMILES | COCCC(OC)OC |
| Synonym | propane, 1,1,3-trimethoxy,propane,1,1,3-trimethoxy,acmc-1brb6,1,1,3-trimethoxy-propane,1,1,3-trimethoxypropane,beta-methoxypropionaldehyde dimethyl acetal |
| IUPAC Name | 1,1,3-trimethoxypropane |
| InChI Key | FKZYYYDRLJCHGL-UHFFFAOYSA-N |
| Molecular Formula | C6H14O3 |
7-Bromo-3,4-dihydro-1,5-benzodioxepin, 96%
CAS: 147644-11-9 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00508291 InChI Key: AZCHNKNSOZJHSH-UHFFFAOYSA-N PubChem CID: 2776394 IUPAC Name: 7-bromo-3,4-dihydro-2H-1,5-benzodioxepine SMILES: C1COC2=C(C=C(C=C2)Br)OC1
| PubChem CID | 2776394 |
|---|---|
| CAS | 147644-11-9 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD00508291 |
| SMILES | C1COC2=C(C=C(C=C2)Br)OC1 |
| IUPAC Name | 7-bromo-3,4-dihydro-2H-1,5-benzodioxepine |
| InChI Key | AZCHNKNSOZJHSH-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
Benzyl chloromethyl ether, tech. 70%
CAS: 3587-60-8 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.609 MDL Number: MFCD00000886 InChI Key: LADPCMZCENPFGV-UHFFFAOYSA-N Synonym: benzyl chloromethyl ether,chloromethoxymethyl benzene,chloromethoxy methyl benzene,benzyloxymethyl chloride,chloromethoxymethyl-benzene,benzyl chloromethylether,benzene, chloromethoxy methyl PubChem CID: 137983 IUPAC Name: chloromethoxymethylbenzene SMILES: C1=CC=C(C=C1)COCCl
| PubChem CID | 137983 |
|---|---|
| CAS | 3587-60-8 |
| Molecular Weight (g/mol) | 156.609 |
| MDL Number | MFCD00000886 |
| SMILES | C1=CC=C(C=C1)COCCl |
| Synonym | benzyl chloromethyl ether,chloromethoxymethyl benzene,chloromethoxy methyl benzene,benzyloxymethyl chloride,chloromethoxymethyl-benzene,benzyl chloromethylether,benzene, chloromethoxy methyl |
| IUPAC Name | chloromethoxymethylbenzene |
| InChI Key | LADPCMZCENPFGV-UHFFFAOYSA-N |
| Molecular Formula | C8H9ClO |
2-Bromo-2'-fluoroacetophenone, 98%
CAS: 655-15-2 Molecular Formula: C8H6BrFO Molecular Weight (g/mol): 217.037 MDL Number: MFCD00278796 InChI Key: QDNWNJSLWKHNTM-UHFFFAOYSA-N Synonym: 2-bromo-2'-fluoroacetophenone,2-bromo-1-2-fluorophenyl ethanone,2-fluorophenacyl bromide,2-bromo-1-2-fluorophenyl ethan-1-one,alpha-bromo-2-fluoroacetophenone,2-fluorophenacylbromide,ethanone, 2-bromo-1-2-fluorophenyl,o-fluorophenacyl bromide,omega-bromo-2-fluoroacetophenone,2-bromo-1-2'-fluorophenyl ethanone PubChem CID: 2737449 IUPAC Name: 2-bromo-1-(2-fluorophenyl)ethanone SMILES: C1=CC=C(C(=C1)C(=O)CBr)F
| PubChem CID | 2737449 |
|---|---|
| CAS | 655-15-2 |
| Molecular Weight (g/mol) | 217.037 |
| MDL Number | MFCD00278796 |
| SMILES | C1=CC=C(C(=C1)C(=O)CBr)F |
| Synonym | 2-bromo-2'-fluoroacetophenone,2-bromo-1-2-fluorophenyl ethanone,2-fluorophenacyl bromide,2-bromo-1-2-fluorophenyl ethan-1-one,alpha-bromo-2-fluoroacetophenone,2-fluorophenacylbromide,ethanone, 2-bromo-1-2-fluorophenyl,o-fluorophenacyl bromide,omega-bromo-2-fluoroacetophenone,2-bromo-1-2'-fluorophenyl ethanone |
| IUPAC Name | 2-bromo-1-(2-fluorophenyl)ethanone |
| InChI Key | QDNWNJSLWKHNTM-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrFO |
2-tert-Butylpropane-1,3-diol, 98%, Thermo Scientific Chemicals
CAS: 2819-05-8 MDL Number: MFCD01075745
| CAS | 2819-05-8 |
|---|---|
| MDL Number | MFCD01075745 |
1-Chloro-N,N,2-trimethylpropenylamine, 98.5+%
CAS: 26189-59-3 Molecular Formula: C6H12ClN Molecular Weight (g/mol): 133.62 InChI Key: GQIRIWDEZSKOCN-UHFFFAOYSA-N Synonym: 1-chloro-n,n,2-trimethylpropenylamine,1-chloro-n,n,2-trimethyl-1-propenylamine,1-chloro-n,n,2-trimethyl-1-propen-1-amine,ghosez inverted exclamation markas reagent,1-propen-1-amine, 1-chloro-n,n,2-trimethyl,1-chloro-2-methylprop-1-en-1-yl dimethylamine,acmc-1ceik,1-chloro-1-dimethylaminoisobutene,1-chloro-2,n,n-trimethylpropenylamine,1-chloro-n,n-2-trimethylpropenylamine PubChem CID: 640792 IUPAC Name: 1-chloro-N,N,2-trimethylprop-1-en-1-amine SMILES: CC(=C(N(C)C)Cl)C
| PubChem CID | 640792 |
|---|---|
| CAS | 26189-59-3 |
| Molecular Weight (g/mol) | 133.62 |
| SMILES | CC(=C(N(C)C)Cl)C |
| Synonym | 1-chloro-n,n,2-trimethylpropenylamine,1-chloro-n,n,2-trimethyl-1-propenylamine,1-chloro-n,n,2-trimethyl-1-propen-1-amine,ghosez inverted exclamation markas reagent,1-propen-1-amine, 1-chloro-n,n,2-trimethyl,1-chloro-2-methylprop-1-en-1-yl dimethylamine,acmc-1ceik,1-chloro-1-dimethylaminoisobutene,1-chloro-2,n,n-trimethylpropenylamine,1-chloro-n,n-2-trimethylpropenylamine |
| IUPAC Name | 1-chloro-N,N,2-trimethylprop-1-en-1-amine |
| InChI Key | GQIRIWDEZSKOCN-UHFFFAOYSA-N |
| Molecular Formula | C6H12ClN |
2',5'-Dichloroacetophenone, 96%, Thermo Scientific™
CAS: 2476-37-1 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.04 MDL Number: MFCD00000607 InChI Key: CYNFEPKQDJHIMV-UHFFFAOYSA-N Synonym: 2',5'-dichloroacetophenone,1-2,5-dichlorophenyl ethanone,2,5-dichloroacetophenone,ethanone, 1-2,5-dichlorophenyl,acetophenone, 2',5'-dichloro,1-2,5-dichlorophenyl ethan-1-one,1-acetyl-2,5-dichlorobenzene,2,5-dichloracetophenon,pubchem10586,acmc-1cmfm PubChem CID: 75587 IUPAC Name: 1-(2,5-dichlorophenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)Cl)Cl
| PubChem CID | 75587 |
|---|---|
| CAS | 2476-37-1 |
| Molecular Weight (g/mol) | 189.04 |
| MDL Number | MFCD00000607 |
| SMILES | CC(=O)C1=C(C=CC(=C1)Cl)Cl |
| Synonym | 2',5'-dichloroacetophenone,1-2,5-dichlorophenyl ethanone,2,5-dichloroacetophenone,ethanone, 1-2,5-dichlorophenyl,acetophenone, 2',5'-dichloro,1-2,5-dichlorophenyl ethan-1-one,1-acetyl-2,5-dichlorobenzene,2,5-dichloracetophenon,pubchem10586,acmc-1cmfm |
| IUPAC Name | 1-(2,5-dichlorophenyl)ethanone |
| InChI Key | CYNFEPKQDJHIMV-UHFFFAOYSA-N |
| Molecular Formula | C8H6Cl2O |
Nonanophenone, Spectrum™ Chemical
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CAS: 6008-36-2 Molecular Weight (g/mol): 218.34
| CAS | 6008-36-2 |
|---|---|
| Molecular Weight (g/mol) | 218.34 |
| CAS | 5392-12-1 |
|---|---|
| MDL Number | MFCD00004004 |
3-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-propanol, 97%
CAS: 51268-87-2 Molecular Formula: C8H16O3 Molecular Weight (g/mol): 160.21 MDL Number: MFCD01631673 InChI Key: BSLDYXOPGSOQGZ-ZETCQYMHSA-N Synonym: 3-4s-2,2-dimethyl-1,3-dioxolan-4-yl propan-1-ol,1,3-dioxolane-4-propanol, 2,2-dimethyl-, s,s-3-2,2-dimethyl-1,3-dioxolan-4-yl propan-1-ol,3-4s-2,2-dimethyl-1,3-dioxolan-4-yl-propanol,1,3-dioxolane-4-propanol,2,2-dimethyl-, 4s,3-2,2-dimethyl-1,3-dioxolane-4 s-yl-propanol,3-2,2-dimethyl-1,3-dioxolane-4beta-yl-1-propanol PubChem CID: 2733890 IUPAC Name: 3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]propan-1-ol SMILES: CC1(OCC(O1)CCCO)C
| PubChem CID | 2733890 |
|---|---|
| CAS | 51268-87-2 |
| Molecular Weight (g/mol) | 160.21 |
| MDL Number | MFCD01631673 |
| SMILES | CC1(OCC(O1)CCCO)C |
| Synonym | 3-4s-2,2-dimethyl-1,3-dioxolan-4-yl propan-1-ol,1,3-dioxolane-4-propanol, 2,2-dimethyl-, s,s-3-2,2-dimethyl-1,3-dioxolan-4-yl propan-1-ol,3-4s-2,2-dimethyl-1,3-dioxolan-4-yl-propanol,1,3-dioxolane-4-propanol,2,2-dimethyl-, 4s,3-2,2-dimethyl-1,3-dioxolane-4 s-yl-propanol,3-2,2-dimethyl-1,3-dioxolane-4beta-yl-1-propanol |
| IUPAC Name | 3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]propan-1-ol |
| InChI Key | BSLDYXOPGSOQGZ-ZETCQYMHSA-N |
| Molecular Formula | C8H16O3 |
Methyl 4-fluorobenzoylacetate, 95%
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
| PubChem CID | 579425 |
|---|---|
| CAS | 63131-29-3 |
| Molecular Weight (g/mol) | 196.177 |
| MDL Number | MFCD00000355 |
| SMILES | COC(=O)CC(=O)C1=CC=C(C=C1)F |
| 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 |
| IUPAC Name | methyl 3-(4-fluorophenyl)-3-oxopropanoate |
| InChI Key | HGLVYXXPRSNKQN-UHFFFAOYSA-N |
| Molecular Formula | C10H9FO3 |