Organooxygen compounds
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1,6-Dimethoxynaphthalene, 98+%
CAS: 3900-49-0 Molecular Formula: C12H12O2 Molecular Weight (g/mol): 188.23 MDL Number: MFCD00086330 InChI Key: RBUFUWIWCCOVOS-UHFFFAOYSA-N Synonym: naphthalene, 1,6-dimethoxy,1,6-dimethoxy naphthalene,1,6-dimethoxy-naphthalene,1,6-dimethoxynaphtalene,1,6-dimethoxynapthalene,maybridge3_002840,acmc-1bn8y,1,6-dimethoxyl naphthalene,1,6-dimethoxynaphthalene PubChem CID: 296916 IUPAC Name: 1,6-dimethoxynaphthalene SMILES: COC1=CC=C2C(OC)=CC=CC2=C1
| PubChem CID | 296916 |
|---|---|
| CAS | 3900-49-0 |
| Molecular Weight (g/mol) | 188.23 |
| MDL Number | MFCD00086330 |
| SMILES | COC1=CC=C2C(OC)=CC=CC2=C1 |
| Synonym | naphthalene, 1,6-dimethoxy,1,6-dimethoxy naphthalene,1,6-dimethoxy-naphthalene,1,6-dimethoxynaphtalene,1,6-dimethoxynapthalene,maybridge3_002840,acmc-1bn8y,1,6-dimethoxyl naphthalene,1,6-dimethoxynaphthalene |
| IUPAC Name | 1,6-dimethoxynaphthalene |
| InChI Key | RBUFUWIWCCOVOS-UHFFFAOYSA-N |
| Molecular Formula | C12H12O2 |
4,4'-Dibromobenzil, 97%
CAS: 35578-47-3 Molecular Formula: C14H8Br2O2 MDL Number: MFCD00000104 InChI Key: NYCBYBDDECLFPE-UHFFFAOYSA-N PubChem CID: 96430
| PubChem CID | 96430 |
|---|---|
| CAS | 35578-47-3 |
| MDL Number | MFCD00000104 |
| InChI Key | NYCBYBDDECLFPE-UHFFFAOYSA-N |
| Molecular Formula | C14H8Br2O2 |
2-Bromo-1-(5-bromo-3-benzo[b]thienyl)ethanone, ≥97%, Thermo Scientific™
CAS: 850375-12-1 Molecular Formula: C10H6Br2OS Molecular Weight (g/mol): 334.025 MDL Number: MFCD06797474 InChI Key: QFZPWQQHQRYUKB-UHFFFAOYSA-N Synonym: 2-bromo-1-5-bromo-3-benzo b thienyl ethanone,2-bromo-1-5-bromo-1-benzothiophen-3-yl ethanone,2-bromo-1-5-bromo-1-benzothiophen-3-yl ethan-1-one,5-bromo-3-bromoacetyl benzo b thiophene,5-bromo-3-bromoacetyl-1-benzothiophene,2-bromo-1-5-bromobenzo b thiophen-3-yl ethanone,ethanone, 2-bromo-1-5-bromobenzo b thien-3-yl,ethanone,2-bromo-1-5-bromobenzo b thien-3-yl PubChem CID: 2795548 IUPAC Name: 2-bromo-1-(5-bromo-1-benzothiophen-3-yl)ethanone SMILES: C1=CC2=C(C=C1Br)C(=CS2)C(=O)CBr
| PubChem CID | 2795548 |
|---|---|
| CAS | 850375-12-1 |
| Molecular Weight (g/mol) | 334.025 |
| MDL Number | MFCD06797474 |
| SMILES | C1=CC2=C(C=C1Br)C(=CS2)C(=O)CBr |
| Synonym | 2-bromo-1-5-bromo-3-benzo b thienyl ethanone,2-bromo-1-5-bromo-1-benzothiophen-3-yl ethanone,2-bromo-1-5-bromo-1-benzothiophen-3-yl ethan-1-one,5-bromo-3-bromoacetyl benzo b thiophene,5-bromo-3-bromoacetyl-1-benzothiophene,2-bromo-1-5-bromobenzo b thiophen-3-yl ethanone,ethanone, 2-bromo-1-5-bromobenzo b thien-3-yl,ethanone,2-bromo-1-5-bromobenzo b thien-3-yl |
| IUPAC Name | 2-bromo-1-(5-bromo-1-benzothiophen-3-yl)ethanone |
| InChI Key | QFZPWQQHQRYUKB-UHFFFAOYSA-N |
| Molecular Formula | C10H6Br2OS |
3-Bromo-4-heptanone, 98%
CAS: 42330-10-9 Molecular Formula: C7H13BrO Molecular Weight (g/mol): 193.08 MDL Number: MFCD09757526 InChI Key: SFKVBRLKXVRUQW-UHFFFAOYNA-N Synonym: 3-bromo-4-heptanone,4-heptanone, 3-bromo PubChem CID: 11469593 IUPAC Name: 3-bromoheptan-4-one SMILES: CCCC(=O)C(Br)CC
| PubChem CID | 11469593 |
|---|---|
| CAS | 42330-10-9 |
| Molecular Weight (g/mol) | 193.08 |
| MDL Number | MFCD09757526 |
| SMILES | CCCC(=O)C(Br)CC |
| Synonym | 3-bromo-4-heptanone,4-heptanone, 3-bromo |
| IUPAC Name | 3-bromoheptan-4-one |
| InChI Key | SFKVBRLKXVRUQW-UHFFFAOYNA-N |
| Molecular Formula | C7H13BrO |
4'-n-Butylacetophenone, 97%
CAS: 37920-25-5 Molecular Formula: C12H16O Molecular Weight (g/mol): 176.26 MDL Number: MFCD00017500 InChI Key: MQESVSITPLILCO-UHFFFAOYSA-N Synonym: 4'-butylacetophenone,1-4-butylphenyl ethanone,ethanone, 1-4-butylphenyl,p-butylacetophenone,1-4-butylphenyl ethan-1-one,p-n-butylacetophenone,4'-n-butylacetophenone,unii-6738cf9z8v,1-acetyl-4-butylbenzene,1-4-butyl-phenyl ethanone PubChem CID: 123470 IUPAC Name: 1-(4-butylphenyl)ethanone SMILES: CCCCC1=CC=C(C=C1)C(C)=O
| PubChem CID | 123470 |
|---|---|
| CAS | 37920-25-5 |
| Molecular Weight (g/mol) | 176.26 |
| MDL Number | MFCD00017500 |
| SMILES | CCCCC1=CC=C(C=C1)C(C)=O |
| Synonym | 4'-butylacetophenone,1-4-butylphenyl ethanone,ethanone, 1-4-butylphenyl,p-butylacetophenone,1-4-butylphenyl ethan-1-one,p-n-butylacetophenone,4'-n-butylacetophenone,unii-6738cf9z8v,1-acetyl-4-butylbenzene,1-4-butyl-phenyl ethanone |
| IUPAC Name | 1-(4-butylphenyl)ethanone |
| InChI Key | MQESVSITPLILCO-UHFFFAOYSA-N |
| Molecular Formula | C12H16O |
3,4-Dihydro-2H-1,5-benzodioxepine-7-carboxylic acid, 97%, Thermo Scientific™
CAS: 20825-89-2 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 MDL Number: MFCD00276310 InChI Key: MQSSBVLREFSMDP-UHFFFAOYSA-N Synonym: 3,4-dihydro-2h-benzo b 1,4 dioxepine-7-carboxylic acid,3,4-dihydro-2h-1,5-benzodioxepin-7-carboxylic acid,2h-1,5-benzodioxepin-7-carboxylic acid, 3,4-dihydro,2h,3h,4h-benzo b 1,4-dioxepin-7-carboxylic acid,acmc-1crio,7-carboxy-3,4-dihydro-2h-1,5-benzodioxepine,2h-1,5-benzodioxepin-7-carboxylicacid, 3,4-dihydro,2h-1,5-benzodioxepin-7-carboxylicacid,3,4-dihydro PubChem CID: 2776383 IUPAC Name: 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylic acid SMILES: C1COC2=C(C=C(C=C2)C(=O)O)OC1
| PubChem CID | 2776383 |
|---|---|
| CAS | 20825-89-2 |
| Molecular Weight (g/mol) | 194.186 |
| MDL Number | MFCD00276310 |
| SMILES | C1COC2=C(C=C(C=C2)C(=O)O)OC1 |
| Synonym | 3,4-dihydro-2h-benzo b 1,4 dioxepine-7-carboxylic acid,3,4-dihydro-2h-1,5-benzodioxepin-7-carboxylic acid,2h-1,5-benzodioxepin-7-carboxylic acid, 3,4-dihydro,2h,3h,4h-benzo b 1,4-dioxepin-7-carboxylic acid,acmc-1crio,7-carboxy-3,4-dihydro-2h-1,5-benzodioxepine,2h-1,5-benzodioxepin-7-carboxylicacid, 3,4-dihydro,2h-1,5-benzodioxepin-7-carboxylicacid,3,4-dihydro |
| IUPAC Name | 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylic acid |
| InChI Key | MQSSBVLREFSMDP-UHFFFAOYSA-N |
| Molecular Formula | C10H10O4 |
2-tert-Butylpropane-1,3-diol, 98%, Thermo Scientific Chemicals
CAS: 2819-05-8 MDL Number: MFCD01075745
| CAS | 2819-05-8 |
|---|---|
| MDL Number | MFCD01075745 |
2-Mercaptoethanol, >98%, MP Biomedicals™
CAS: 60-24-2 Molecular Formula: C2H6OS Molecular Weight (g/mol): 78.13 MDL Number: MFCD00004890 InChI Key: DGVVWUTYPXICAM-UHFFFAOYSA-N Synonym: 2-mercaptoethanol,mercaptoethanol,thioglycol,beta-mercaptoethanol,ethanol, 2-mercapto,2-thioethanol,2-hydroxy-1-ethanethiol,thioethylene glycol,2-hydroxyethanethiol,2-hydroxyethyl mercaptan PubChem CID: 1567 ChEBI: CHEBI:41218 IUPAC Name: 2-sulfanylethanol SMILES: OCCS
| PubChem CID | 1567 |
|---|---|
| CAS | 60-24-2 |
| Molecular Weight (g/mol) | 78.13 |
| ChEBI | CHEBI:41218 |
| MDL Number | MFCD00004890 |
| SMILES | OCCS |
| Synonym | 2-mercaptoethanol,mercaptoethanol,thioglycol,beta-mercaptoethanol,ethanol, 2-mercapto,2-thioethanol,2-hydroxy-1-ethanethiol,thioethylene glycol,2-hydroxyethanethiol,2-hydroxyethyl mercaptan |
| IUPAC Name | 2-sulfanylethanol |
| InChI Key | DGVVWUTYPXICAM-UHFFFAOYSA-N |
| Molecular Formula | C2H6OS |
2-Ethoxyethanol, Reagent Grade, 99%, Solstice
CAS: 110-80-5 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.12 MDL Number: MFCD00002869 InChI Key: ZNQVEEAIQZEUHB-UHFFFAOYSA-N Synonym: cellosolve,oxitol,ethyl cellosolve,ethylene glycol monoethyl ether,ethanol, 2-ethoxy,ethyl glycol,emkanol,hydroxy ether,ethylene glycol ethyl ether,dowanol ee PubChem CID: 8076 ChEBI: CHEBI:46788 SMILES: CCOCCO
| PubChem CID | 8076 |
|---|---|
| CAS | 110-80-5 |
| Molecular Weight (g/mol) | 90.12 |
| ChEBI | CHEBI:46788 |
| MDL Number | MFCD00002869 |
| SMILES | CCOCCO |
| Synonym | cellosolve,oxitol,ethyl cellosolve,ethylene glycol monoethyl ether,ethanol, 2-ethoxy,ethyl glycol,emkanol,hydroxy ether,ethylene glycol ethyl ether,dowanol ee |
| InChI Key | ZNQVEEAIQZEUHB-UHFFFAOYSA-N |
| Molecular Formula | C4H10O2 |
3-(Bromoacetyl)pyridine hydrobromide, 98%
CAS: 17694-68-7 Molecular Formula: C7H7Br2NO Molecular Weight (g/mol): 280.95 MDL Number: MFCD00052182 InChI Key: WDTSYONULAZKIE-UHFFFAOYSA-N Synonym: 2-bromo-1-pyridin-3-yl ethanone hydrobromide,3-bromoacetyl pyridine hydrobromide,3-2-bromoacetyl pyridine hydrobromide,2-bromo-1-3-pyridinyl ethanone hydrobromide,3-bromoacetyl pyridinium bromide,3-bromoacetyl pyridine hbr,2-bromo-1-pyridin-3-ylethan-1-one hydrobromide,2-bromo-1-pyridin-3-ylethanone hydrobromide,3-bromoacetylpyridine hydrobromide PubChem CID: 2776234 IUPAC Name: 2-bromo-1-pyridin-3-ylethanone;hydrobromide SMILES: [H+].[Br-].BrCC(=O)C1=CC=CN=C1
| PubChem CID | 2776234 |
|---|---|
| CAS | 17694-68-7 |
| Molecular Weight (g/mol) | 280.95 |
| MDL Number | MFCD00052182 |
| SMILES | [H+].[Br-].BrCC(=O)C1=CC=CN=C1 |
| Synonym | 2-bromo-1-pyridin-3-yl ethanone hydrobromide,3-bromoacetyl pyridine hydrobromide,3-2-bromoacetyl pyridine hydrobromide,2-bromo-1-3-pyridinyl ethanone hydrobromide,3-bromoacetyl pyridinium bromide,3-bromoacetyl pyridine hbr,2-bromo-1-pyridin-3-ylethan-1-one hydrobromide,2-bromo-1-pyridin-3-ylethanone hydrobromide,3-bromoacetylpyridine hydrobromide |
| IUPAC Name | 2-bromo-1-pyridin-3-ylethanone;hydrobromide |
| InChI Key | WDTSYONULAZKIE-UHFFFAOYSA-N |
| Molecular Formula | C7H7Br2NO |
3',5'-Bis(trifluoromethyl)acetophenone, 98%
CAS: 30071-93-3 Molecular Formula: C10H6F6O Molecular Weight (g/mol): 256.15 MDL Number: MFCD00009910 InChI Key: MCYCSIKSZLARBD-UHFFFAOYSA-N Synonym: 3',5'-bis trifluoromethyl acetophenone,3,5-bis trifluoromethyl acetophenone,1-3,5-bis trifluoromethyl phenyl ethanone,1-3,5-bis trifluoromethyl phenyl ethan-1-one,mbt-ac,1-3,5-di trifluoromethyl phenyl ethan-1-one,3,5-ditrifluoromethylacetophenone,3',5'-bis-trifluoromethylacetophenone PubChem CID: 121616 SMILES: CC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F
| PubChem CID | 121616 |
|---|---|
| CAS | 30071-93-3 |
| Molecular Weight (g/mol) | 256.15 |
| MDL Number | MFCD00009910 |
| SMILES | CC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F |
| Synonym | 3',5'-bis trifluoromethyl acetophenone,3,5-bis trifluoromethyl acetophenone,1-3,5-bis trifluoromethyl phenyl ethanone,1-3,5-bis trifluoromethyl phenyl ethan-1-one,mbt-ac,1-3,5-di trifluoromethyl phenyl ethan-1-one,3,5-ditrifluoromethylacetophenone,3',5'-bis-trifluoromethylacetophenone |
| InChI Key | MCYCSIKSZLARBD-UHFFFAOYSA-N |
| Molecular Formula | C10H6F6O |
4'-Hydroxy-3'-methoxyacetophenone, 98%
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)ethanone SMILES: COC1=CC(=CC=C1O)C(C)=O
| PubChem CID | 2214 |
|---|---|
| CAS | 498-02-2 |
| Molecular Weight (g/mol) | 166.18 |
| ChEBI | CHEBI:2781 |
| MDL Number | MFCD00008747 |
| SMILES | COC1=CC(=CC=C1O)C(C)=O |
| Synonym | acetovanillone,apocynin,4'-hydroxy-3'-methoxyacetophenone,1-4-hydroxy-3-methoxyphenyl ethanone,acetoguaiacone,acetoguaiacon,apocynine,4-acetyl-2-methoxyphenol,acetovanilone,acetovanyllon |
| IUPAC Name | 1-(4-hydroxy-3-methoxyphenyl)ethanone |
| InChI Key | DFYRUELUNQRZTB-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
2',6'-Difluoroacetophenone, 98%
CAS: 13670-99-0 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.13 MDL Number: MFCD00000328 InChI Key: VGIIILXIQLXVLC-UHFFFAOYSA-N Synonym: 2',6'-difluoroacetophenone,1-2,6-difluorophenyl ethanone,2,6-difluoroacetophenone,1-2,6-difluorophenyl ethan-1-one,ethanone, 1-2,6-difluorophenyl,acetophenone, 2',6'-difluoro,1-acetyl-2,6-difluorobenzene,fr cf bv1,pubchem4218,intermediates-zcf02054 PubChem CID: 83643 SMILES: CC(=O)C1=C(F)C=CC=C1F
| PubChem CID | 83643 |
|---|---|
| CAS | 13670-99-0 |
| Molecular Weight (g/mol) | 156.13 |
| MDL Number | MFCD00000328 |
| SMILES | CC(=O)C1=C(F)C=CC=C1F |
| Synonym | 2',6'-difluoroacetophenone,1-2,6-difluorophenyl ethanone,2,6-difluoroacetophenone,1-2,6-difluorophenyl ethan-1-one,ethanone, 1-2,6-difluorophenyl,acetophenone, 2',6'-difluoro,1-acetyl-2,6-difluorobenzene,fr cf bv1,pubchem4218,intermediates-zcf02054 |
| InChI Key | VGIIILXIQLXVLC-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O |
2-Acetyl-5-chlorothiophene, 99%
CAS: 6310-09-4 Molecular Formula: C6H5ClOS Molecular Weight (g/mol): 160.62 MDL Number: MFCD00005444 InChI Key: HTZGPEHWQCRXGZ-UHFFFAOYSA-N Synonym: 2-acetyl-5-chlorothiophene,1-5-chlorothiophen-2-yl ethanone,1-5-chloro-2-thienyl ethanone,5-chloro-2-acetylthiophene,ethanone, 1-5-chloro-2-thienyl,5-chlor-2-acetyl thiophen,ketone, 5-chloro-2-thienyl methyl,1-5-chlorothiophen-2-yl ethan-1-one,5-chloro-2-thienyl methyl ketone,2-chloro-5-acetylthiophene PubChem CID: 80572 IUPAC Name: 1-(5-chlorothiophen-2-yl)ethanone SMILES: CC(=O)C1=CC=C(S1)Cl
| PubChem CID | 80572 |
|---|---|
| CAS | 6310-09-4 |
| Molecular Weight (g/mol) | 160.62 |
| MDL Number | MFCD00005444 |
| SMILES | CC(=O)C1=CC=C(S1)Cl |
| Synonym | 2-acetyl-5-chlorothiophene,1-5-chlorothiophen-2-yl ethanone,1-5-chloro-2-thienyl ethanone,5-chloro-2-acetylthiophene,ethanone, 1-5-chloro-2-thienyl,5-chlor-2-acetyl thiophen,ketone, 5-chloro-2-thienyl methyl,1-5-chlorothiophen-2-yl ethan-1-one,5-chloro-2-thienyl methyl ketone,2-chloro-5-acetylthiophene |
| IUPAC Name | 1-(5-chlorothiophen-2-yl)ethanone |
| InChI Key | HTZGPEHWQCRXGZ-UHFFFAOYSA-N |
| Molecular Formula | C6H5ClOS |
1,2-Dimethoxyethane, ≥99%, Reagent Grade, Inhibitor-free, Solstice
CAS: 110-71-4 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.122 MDL Number: MFCD00008502 InChI Key: XTHFKEDIFFGKHM-UHFFFAOYSA-N Synonym: monoglyme,ethylene glycol dimethyl ether,glyme,dimethyl cellosolve,egdme,ethane, 1,2-dimethoxy,dimethoxyethane,2,5-dioxahexane,glycol dimethyl ether,ethylene dimethyl ether PubChem CID: 8071 ChEBI: CHEBI:42263 IUPAC Name: 1,2-dimethoxyethane SMILES: COCCOC
| PubChem CID | 8071 |
|---|---|
| CAS | 110-71-4 |
| Molecular Weight (g/mol) | 90.122 |
| ChEBI | CHEBI:42263 |
| MDL Number | MFCD00008502 |
| SMILES | COCCOC |
| Synonym | monoglyme,ethylene glycol dimethyl ether,glyme,dimethyl cellosolve,egdme,ethane, 1,2-dimethoxy,dimethoxyethane,2,5-dioxahexane,glycol dimethyl ether,ethylene dimethyl ether |
| IUPAC Name | 1,2-dimethoxyethane |
| InChI Key | XTHFKEDIFFGKHM-UHFFFAOYSA-N |
| Molecular Formula | C4H10O2 |