Organooxygen compounds
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2-Hydroxymethyl-12-crown-4, 97%
CAS: 75507-26-5 Molecular Formula: C9H18O5 Molecular Weight (g/mol): 206.238 MDL Number: MFCD00067524 InChI Key: NJIPEIQHUNDGPY-UHFFFAOYSA-N PubChem CID: 2733085 IUPAC Name: 1,4,7,10-tetraoxacyclododec-2-ylmethanol SMILES: C1COCCOC(COCCO1)CO
| PubChem CID | 2733085 |
|---|---|
| CAS | 75507-26-5 |
| Molecular Weight (g/mol) | 206.238 |
| MDL Number | MFCD00067524 |
| SMILES | C1COCCOC(COCCO1)CO |
| IUPAC Name | 1,4,7,10-tetraoxacyclododec-2-ylmethanol |
| InChI Key | NJIPEIQHUNDGPY-UHFFFAOYSA-N |
| Molecular Formula | C9H18O5 |
3-Hydroxyazetidine, 95%, Thermo Scientific Chemicals
CAS: 45347-82-8 Molecular Formula: C3H7NO Molecular Weight (g/mol): 73.10 MDL Number: MFCD03695446 InChI Key: GMWFCJXSQQHBPI-UHFFFAOYSA-N IUPAC Name: azetidin-3-ol SMILES: OC1CNC1
| CAS | 45347-82-8 |
|---|---|
| Molecular Weight (g/mol) | 73.10 |
| MDL Number | MFCD03695446 |
| SMILES | OC1CNC1 |
| IUPAC Name | azetidin-3-ol |
| InChI Key | GMWFCJXSQQHBPI-UHFFFAOYSA-N |
| Molecular Formula | C3H7NO |
Ethyl 3,3-diethoxypropionate, 96%
CAS: 10601-80-6 Molecular Formula: C9H18O4 Molecular Weight (g/mol): 190.239 MDL Number: MFCD00009865 InChI Key: SIALOQYKFQEKOG-UHFFFAOYSA-N PubChem CID: 66389 IUPAC Name: ethyl 3,3-diethoxypropanoate SMILES: CCOC(CC(=O)OCC)OCC
| PubChem CID | 66389 |
|---|---|
| CAS | 10601-80-6 |
| Molecular Weight (g/mol) | 190.239 |
| MDL Number | MFCD00009865 |
| SMILES | CCOC(CC(=O)OCC)OCC |
| IUPAC Name | ethyl 3,3-diethoxypropanoate |
| InChI Key | SIALOQYKFQEKOG-UHFFFAOYSA-N |
| Molecular Formula | C9H18O4 |
(4-Bromophenyl)cyclopropylmethanone, 95%
CAS: 6952-89-2 MDL Number: MFCD00019227 InChI Key: QTHHOINSCNBYQO-UHFFFAOYSA-N Synonym: 4-bromophenyl cyclopropyl methanone,4-bromophenyl cyclopropyl ketone,4-bromophenyl cyclopropylmethanone,methanone, 4-bromophenyl cyclopropyl,4-bromo-cyclopropylcarbonylbenzene,acmc-1bag8,4-bromobenzoyl cyclopropane,bromophenylcyclopropylmethanone PubChem CID: 81394 IUPAC Name: (4-bromophenyl)-cyclopropylmethanone SMILES: C1CC1C(=O)C2=CC=C(C=C2)Br
| PubChem CID | 81394 |
|---|---|
| CAS | 6952-89-2 |
| MDL Number | MFCD00019227 |
| SMILES | C1CC1C(=O)C2=CC=C(C=C2)Br |
| Synonym | 4-bromophenyl cyclopropyl methanone,4-bromophenyl cyclopropyl ketone,4-bromophenyl cyclopropylmethanone,methanone, 4-bromophenyl cyclopropyl,4-bromo-cyclopropylcarbonylbenzene,acmc-1bag8,4-bromobenzoyl cyclopropane,bromophenylcyclopropylmethanone |
| IUPAC Name | (4-bromophenyl)-cyclopropylmethanone |
| InChI Key | QTHHOINSCNBYQO-UHFFFAOYSA-N |
2',4'-Dimethoxyacetophenone, 98%
CAS: 829-20-9 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00008727 InChI Key: VQTDPCRSXHFMOL-UHFFFAOYSA-N Synonym: 2',4'-dimethoxyacetophenone,1-2,4-dimethoxyphenyl ethanone,2,4-dimethoxyacetophenone,1-2,4-dimethoxyphenyl ethan-1-one,ethanone, 1-2,4-dimethoxyphenyl,acetophenone, 2',4'-dimethoxy,peonol methyl ether,1-acetyl-2,4-dimethoxybenzene,pubchem10582,acmc-209pqs PubChem CID: 70016 IUPAC Name: 1-(2,4-dimethoxyphenyl)ethanone SMILES: CC(=O)C1=C(C=C(C=C1)OC)OC
| PubChem CID | 70016 |
|---|---|
| CAS | 829-20-9 |
| Molecular Weight (g/mol) | 180.203 |
| MDL Number | MFCD00008727 |
| SMILES | CC(=O)C1=C(C=C(C=C1)OC)OC |
| Synonym | 2',4'-dimethoxyacetophenone,1-2,4-dimethoxyphenyl ethanone,2,4-dimethoxyacetophenone,1-2,4-dimethoxyphenyl ethan-1-one,ethanone, 1-2,4-dimethoxyphenyl,acetophenone, 2',4'-dimethoxy,peonol methyl ether,1-acetyl-2,4-dimethoxybenzene,pubchem10582,acmc-209pqs |
| IUPAC Name | 1-(2,4-dimethoxyphenyl)ethanone |
| InChI Key | VQTDPCRSXHFMOL-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
4'-Fluoro-3'-nitroacetophenone, 98%, Thermo Scientific™
CAS: 400-93-1 Molecular Formula: C8H6FNO3 Molecular Weight (g/mol): 183.14 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-]
| PubChem CID | 2734612 |
|---|---|
| CAS | 400-93-1 |
| Molecular Weight (g/mol) | 183.14 |
| MDL Number | MFCD00115369 |
| SMILES | CC(=O)C1=CC(=C(C=C1)F)[N+](=O)[O-] |
| 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 |
| IUPAC Name | 1-(4-fluoro-3-nitrophenyl)ethanone |
| InChI Key | PTCNZDJJIOLIKQ-UHFFFAOYSA-N |
| Molecular Formula | C8H6FNO3 |
Spectrum Chemical Manufacturing Corporation Diethylene Glycol, 97%, Spectrum™ Chemical
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CAS: 111-46-6
| CAS | 111-46-6 |
|---|
2'-Fluoro-4'-methoxyacetophenone, 99%
CAS: 74457-86-6 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.17 MDL Number: MFCD00042290 InChI Key: PIRRWUMTIBFCCW-UHFFFAOYSA-N Synonym: 2'-fluoro-4'-methoxyacetophenone,2-fluoro-4-methoxyacetophenone,1-2-fluoro-4-methoxyphenyl ethanone,1-2-fluoro-4-methoxyphenyl ethan-1-one,4-acetyl-3-fluoroanisole,1-acetyl-2-fluoro-4-methoxybenzene,2'-fluor-4'-methoxyacetophenone,2-fluoro-4-methoxy-acetophenone,ethanone, 1-2-fluoro-4-methoxyphenyl,zlchem 344 PubChem CID: 592821 IUPAC Name: 1-(2-fluoro-4-methoxyphenyl)ethanone SMILES: COC1=CC=C(C(C)=O)C(F)=C1
| PubChem CID | 592821 |
|---|---|
| CAS | 74457-86-6 |
| Molecular Weight (g/mol) | 168.17 |
| MDL Number | MFCD00042290 |
| SMILES | COC1=CC=C(C(C)=O)C(F)=C1 |
| Synonym | 2'-fluoro-4'-methoxyacetophenone,2-fluoro-4-methoxyacetophenone,1-2-fluoro-4-methoxyphenyl ethanone,1-2-fluoro-4-methoxyphenyl ethan-1-one,4-acetyl-3-fluoroanisole,1-acetyl-2-fluoro-4-methoxybenzene,2'-fluor-4'-methoxyacetophenone,2-fluoro-4-methoxy-acetophenone,ethanone, 1-2-fluoro-4-methoxyphenyl,zlchem 344 |
| IUPAC Name | 1-(2-fluoro-4-methoxyphenyl)ethanone |
| InChI Key | PIRRWUMTIBFCCW-UHFFFAOYSA-N |
| Molecular Formula | C9H9FO2 |
Mono-Ethyl malonate, 95%
CAS: 1071-46-1 Molecular Formula: C5H8O4 Molecular Weight (g/mol): 132.11 MDL Number: MFCD00020490 InChI Key: HGINADPHJQTSKN-UHFFFAOYSA-N Synonym: ethyl hydrogen malonate,monoethyl malonate,monoethyl malonic acid,mono-ethyl malonate,monoethyl hydrogen malonate,malonic acid monoethyl ester,ethoxycarbonyl acetic acid,2-ethoxycarbonyl acetic acid,3-ethoxy-3-oxo-propanoic acid,ethylhydrogenmalonate PubChem CID: 70615 ChEBI: CHEBI:86907 IUPAC Name: 3-ethoxy-3-oxopropanoic acid SMILES: CCOC(=O)CC(=O)O
| PubChem CID | 70615 |
|---|---|
| CAS | 1071-46-1 |
| Molecular Weight (g/mol) | 132.11 |
| ChEBI | CHEBI:86907 |
| MDL Number | MFCD00020490 |
| SMILES | CCOC(=O)CC(=O)O |
| Synonym | ethyl hydrogen malonate,monoethyl malonate,monoethyl malonic acid,mono-ethyl malonate,monoethyl hydrogen malonate,malonic acid monoethyl ester,ethoxycarbonyl acetic acid,2-ethoxycarbonyl acetic acid,3-ethoxy-3-oxo-propanoic acid,ethylhydrogenmalonate |
| IUPAC Name | 3-ethoxy-3-oxopropanoic acid |
| InChI Key | HGINADPHJQTSKN-UHFFFAOYSA-N |
| Molecular Formula | C5H8O4 |
3-Buten-1-ol, 98+%
CAS: 627-27-0 MDL Number: MFCD00002959 InChI Key: ZSPTYLOMNJNZNG-UHFFFAOYSA-N Synonym: 3-buten-1-ol,allylcarbinol,3-butenyl alcohol,1-buten-4-ol,vinylethyl alcohol,3-butene-1-ol,ch2=chch2ch2oh,homoallyl alcohol,unii-3db2krm1i9,1-hydroxy-3-butene PubChem CID: 69389 IUPAC Name: but-3-en-1-ol SMILES: C=CCCO
| PubChem CID | 69389 |
|---|---|
| CAS | 627-27-0 |
| MDL Number | MFCD00002959 |
| SMILES | C=CCCO |
| Synonym | 3-buten-1-ol,allylcarbinol,3-butenyl alcohol,1-buten-4-ol,vinylethyl alcohol,3-butene-1-ol,ch2=chch2ch2oh,homoallyl alcohol,unii-3db2krm1i9,1-hydroxy-3-butene |
| IUPAC Name | but-3-en-1-ol |
| InChI Key | ZSPTYLOMNJNZNG-UHFFFAOYSA-N |
4-Isopropoxybenzaldehyde, 97%
CAS: 18962-05-5 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00052357 InChI Key: WDANSDASCKBVKH-UHFFFAOYSA-N Synonym: 4-isopropoxybenzaldehyde,4-propan-2-yloxy benzaldehyde,4-iso-propoxybenzaldehyde,benzaldehyde, 4-1-methylethoxy,4-propan-2-yl-oxy benzaldehyde,4-isopropoxy-1-formylbenzene,4-methylethoxy benzaldehyde,pubchem9651,p-isopropoxybenzaldehyde,4-isopropoxy-benzaldehyde PubChem CID: 250077 IUPAC Name: 4-propan-2-yloxybenzaldehyde SMILES: CC(C)OC1=CC=C(C=C1)C=O
| PubChem CID | 250077 |
|---|---|
| CAS | 18962-05-5 |
| Molecular Weight (g/mol) | 164.204 |
| MDL Number | MFCD00052357 |
| SMILES | CC(C)OC1=CC=C(C=C1)C=O |
| Synonym | 4-isopropoxybenzaldehyde,4-propan-2-yloxy benzaldehyde,4-iso-propoxybenzaldehyde,benzaldehyde, 4-1-methylethoxy,4-propan-2-yl-oxy benzaldehyde,4-isopropoxy-1-formylbenzene,4-methylethoxy benzaldehyde,pubchem9651,p-isopropoxybenzaldehyde,4-isopropoxy-benzaldehyde |
| IUPAC Name | 4-propan-2-yloxybenzaldehyde |
| InChI Key | WDANSDASCKBVKH-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
Dipentaerythritol, 80+%, technical
CAS: 126-58-9 Molecular Formula: C10H22O7 Molecular Weight (g/mol): 254.28 MDL Number: MFCD00004691 InChI Key: TXBCBTDQIULDIA-UHFFFAOYSA-N Synonym: dipentaerythritol,dipentek,2,2'-oxybis methylene bis 2-hydroxymethyl propane-1,3-diol,bis pentaerythritol,1,3-propanediol, 2,2'-oxybis methylene bis 2-hydroxymethyl,2,2,2',2'-tetrakis hydroxymethyl-3,3'-oxydipropan-1-ol,1,3-propanediol, 2,2'-oxybis-methylene,2-3-hydroxy-2,2-bis hydroxymethyl propoxy methyl-2-hydroxymethyl propane-1,3-diol PubChem CID: 31352 IUPAC Name: 2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol SMILES: C(C(CO)(CO)COCC(CO)(CO)CO)O
| PubChem CID | 31352 |
|---|---|
| CAS | 126-58-9 |
| Molecular Weight (g/mol) | 254.28 |
| MDL Number | MFCD00004691 |
| SMILES | C(C(CO)(CO)COCC(CO)(CO)CO)O |
| Synonym | dipentaerythritol,dipentek,2,2'-oxybis methylene bis 2-hydroxymethyl propane-1,3-diol,bis pentaerythritol,1,3-propanediol, 2,2'-oxybis methylene bis 2-hydroxymethyl,2,2,2',2'-tetrakis hydroxymethyl-3,3'-oxydipropan-1-ol,1,3-propanediol, 2,2'-oxybis-methylene,2-3-hydroxy-2,2-bis hydroxymethyl propoxy methyl-2-hydroxymethyl propane-1,3-diol |
| IUPAC Name | 2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol |
| InChI Key | TXBCBTDQIULDIA-UHFFFAOYSA-N |
| Molecular Formula | C10H22O7 |
3,4-Dihydro-2H-1,5-benzodioxepin-7-amine, 98%
CAS: 175136-34-2 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 MDL Number: MFCD00218806 InChI Key: FVLCICVRAPEYNX-UHFFFAOYSA-N PubChem CID: 2775654 IUPAC Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-amine SMILES: C1COC2=C(C=C(C=C2)N)OC1
| PubChem CID | 2775654 |
|---|---|
| CAS | 175136-34-2 |
| Molecular Weight (g/mol) | 165.192 |
| MDL Number | MFCD00218806 |
| SMILES | C1COC2=C(C=C(C=C2)N)OC1 |
| IUPAC Name | 3,4-dihydro-2H-1,5-benzodioxepin-7-amine |
| InChI Key | FVLCICVRAPEYNX-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO2 |
2-Fluoro-4-hydroxybenzaldehyde, 97%
CAS: 348-27-6 Molecular Formula: C7H5FO2 Molecular Weight (g/mol): 140.113 MDL Number: MFCD06797918 InChI Key: ONRPXRPUBXXCCM-UHFFFAOYSA-N Synonym: 2-fluoro-4-hydroxy-benzaldehyde,benzaldehyde, 2-fluoro-4-hydroxy,pubchem1442,acmc-1act5,ksc497m4n,# PubChem CID: 587246 IUPAC Name: 2-fluoro-4-hydroxybenzaldehyde SMILES: C1=CC(=C(C=C1O)F)C=O
| PubChem CID | 587246 |
|---|---|
| CAS | 348-27-6 |
| Molecular Weight (g/mol) | 140.113 |
| MDL Number | MFCD06797918 |
| SMILES | C1=CC(=C(C=C1O)F)C=O |
| Synonym | 2-fluoro-4-hydroxy-benzaldehyde,benzaldehyde, 2-fluoro-4-hydroxy,pubchem1442,acmc-1act5,ksc497m4n,# |
| IUPAC Name | 2-fluoro-4-hydroxybenzaldehyde |
| InChI Key | ONRPXRPUBXXCCM-UHFFFAOYSA-N |
| Molecular Formula | C7H5FO2 |
4'-Bromo-4-chlorobutyrophenone, 98%
CAS: 4559-96-0 Molecular Formula: C10H10BrClO Molecular Weight (g/mol): 261.54 MDL Number: MFCD00001006 InChI Key: WJKPUMBLABGUCQ-UHFFFAOYSA-N Synonym: 1-4-bromophenyl-4-chlorobutan-1-one,4'-bromo-4-chlorobutyrophenone,1-4-bromophenyl-4-chloro-1-butanone,1-butanone, 1-4-bromophenyl-4-chloro,acmc-20amn1,4-chloro-p-bromobutyrophenone,4-chloro-4'-bromobutyrophenone,4-bromo-4-chlorobutyrophenone,4/'-bromo-4-chlorobutyrophenone,4'-bromo-gamma-chlorobutyrophenone PubChem CID: 78317 IUPAC Name: 1-(4-bromophenyl)-4-chlorobutan-1-one SMILES: ClCCCC(=O)C1=CC=C(Br)C=C1
| PubChem CID | 78317 |
|---|---|
| CAS | 4559-96-0 |
| Molecular Weight (g/mol) | 261.54 |
| MDL Number | MFCD00001006 |
| SMILES | ClCCCC(=O)C1=CC=C(Br)C=C1 |
| Synonym | 1-4-bromophenyl-4-chlorobutan-1-one,4'-bromo-4-chlorobutyrophenone,1-4-bromophenyl-4-chloro-1-butanone,1-butanone, 1-4-bromophenyl-4-chloro,acmc-20amn1,4-chloro-p-bromobutyrophenone,4-chloro-4'-bromobutyrophenone,4-bromo-4-chlorobutyrophenone,4/'-bromo-4-chlorobutyrophenone,4'-bromo-gamma-chlorobutyrophenone |
| IUPAC Name | 1-(4-bromophenyl)-4-chlorobutan-1-one |
| InChI Key | WJKPUMBLABGUCQ-UHFFFAOYSA-N |
| Molecular Formula | C10H10BrClO |