Organooxygen compounds
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2',6'-Dihydroxyacetophenone 97.0+%, TCI America™
CAS: 699-83-2 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002270 InChI Key: YPTJKHVBDCRKNF-UHFFFAOYSA-N Synonym: 2',6'-dihydroxyacetophenone,1-2,6-dihydroxyphenyl ethanone,2,6-dihydroxyacetophenone,2-acetylresorcinol,resorcinol, 2-acetyl,1-2,6-dihydroxyphenyl ethan-1-one,2,6-dihydroxy acetophenone,gamma-resacetophenone,ethanone, 1-2,6-dihydroxyphenyl,unii-88bo51g3y2 PubChem CID: 69687 IUPAC Name: 1-(2,6-dihydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=CC=C1O)O
| PubChem CID | 69687 |
|---|---|
| CAS | 699-83-2 |
| Molecular Weight (g/mol) | 152.149 |
| MDL Number | MFCD00002270 |
| SMILES | CC(=O)C1=C(C=CC=C1O)O |
| Synonym | 2',6'-dihydroxyacetophenone,1-2,6-dihydroxyphenyl ethanone,2,6-dihydroxyacetophenone,2-acetylresorcinol,resorcinol, 2-acetyl,1-2,6-dihydroxyphenyl ethan-1-one,2,6-dihydroxy acetophenone,gamma-resacetophenone,ethanone, 1-2,6-dihydroxyphenyl,unii-88bo51g3y2 |
| IUPAC Name | 1-(2,6-dihydroxyphenyl)ethanone |
| InChI Key | YPTJKHVBDCRKNF-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
Disperse Blue 14, TCI America™
CAS: 2475-44-7 Molecular Formula: C16H14N2O2 Molecular Weight (g/mol): 266.30 MDL Number: MFCD00001198 InChI Key: QOSTVEDABRQTSU-UHFFFAOYSA-N Synonym: disperse blue 14,1,4-bis methylamino anthraquinone,resiren blue tb,solvent blue 78,acetate blue b,celliton fast blue b,cibacet blue br,setacyl blue bs,teraprint blue r,1,4-bis methylamino anthracene-9,10-dione PubChem CID: 17189 IUPAC Name: 1,4-bis(methylamino)-9,10-dihydroanthracene-9,10-dione SMILES: CNC1=CC=C(NC)C2=C1C(=O)C1=CC=CC=C1C2=O
| PubChem CID | 17189 |
|---|---|
| CAS | 2475-44-7 |
| Molecular Weight (g/mol) | 266.30 |
| MDL Number | MFCD00001198 |
| SMILES | CNC1=CC=C(NC)C2=C1C(=O)C1=CC=CC=C1C2=O |
| Synonym | disperse blue 14,1,4-bis methylamino anthraquinone,resiren blue tb,solvent blue 78,acetate blue b,celliton fast blue b,cibacet blue br,setacyl blue bs,teraprint blue r,1,4-bis methylamino anthracene-9,10-dione |
| IUPAC Name | 1,4-bis(methylamino)-9,10-dihydroanthracene-9,10-dione |
| InChI Key | QOSTVEDABRQTSU-UHFFFAOYSA-N |
| Molecular Formula | C16H14N2O2 |
2,2-Dimethyl-1-propanol 98.0+%, TCI America™
CAS: 75-84-3 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00004682 InChI Key: KPSSIOMAKSHJJG-UHFFFAOYSA-N Synonym: neopentyl alcohol,2,2-dimethyl-1-propanol,2,2-dimethylpropanol,tert-butylcarbinol,1-propanol, 2,2-dimethyl,tert-butyl carbinol,neopentanol,neopentylalcohol,neoamyl alcohol,2,2-dimethylpropyl alcohol PubChem CID: 6404 IUPAC Name: 2,2-dimethylpropan-1-ol SMILES: CC(C)(C)CO
| PubChem CID | 6404 |
|---|---|
| CAS | 75-84-3 |
| Molecular Weight (g/mol) | 88.15 |
| MDL Number | MFCD00004682 |
| SMILES | CC(C)(C)CO |
| Synonym | neopentyl alcohol,2,2-dimethyl-1-propanol,2,2-dimethylpropanol,tert-butylcarbinol,1-propanol, 2,2-dimethyl,tert-butyl carbinol,neopentanol,neopentylalcohol,neoamyl alcohol,2,2-dimethylpropyl alcohol |
| IUPAC Name | 2,2-dimethylpropan-1-ol |
| InChI Key | KPSSIOMAKSHJJG-UHFFFAOYSA-N |
| Molecular Formula | C5H12O |
4,6-Dimethoxypyrimidine 98.0+%, TCI America™
CAS: 5270-94-0 Molecular Formula: C6H8N2O2 Molecular Weight (g/mol): 140.142 MDL Number: MFCD00955844 InChI Key: FPSPPRZKBUVEJQ-UHFFFAOYSA-N PubChem CID: 259821 IUPAC Name: 4,6-dimethoxypyrimidine SMILES: COC1=CC(=NC=N1)OC
| PubChem CID | 259821 |
|---|---|
| CAS | 5270-94-0 |
| Molecular Weight (g/mol) | 140.142 |
| MDL Number | MFCD00955844 |
| SMILES | COC1=CC(=NC=N1)OC |
| IUPAC Name | 4,6-dimethoxypyrimidine |
| InChI Key | FPSPPRZKBUVEJQ-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O2 |
2-Ethoxyethyl Acetate 98.0+%, TCI America™
CAS: 111-15-9 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.16 MDL Number: MFCD00009251 InChI Key: SVONRAPFKPVNKG-UHFFFAOYSA-N Synonym: ethylene glycol monoethyl ether acetate,cellosolve acetate,oxitol acetate,ethoxyethyl acetate,oxytol acetate,ethylglycol acetate,ethyl cellosolve acetate,1-acetoxy-2-ethoxyethane,ethylglykolacetat,octan etoksyetylu PubChem CID: 8095 IUPAC Name: 2-ethoxyethyl acetate SMILES: CCOCCOC(C)=O
| PubChem CID | 8095 |
|---|---|
| CAS | 111-15-9 |
| Molecular Weight (g/mol) | 132.16 |
| MDL Number | MFCD00009251 |
| SMILES | CCOCCOC(C)=O |
| Synonym | ethylene glycol monoethyl ether acetate,cellosolve acetate,oxitol acetate,ethoxyethyl acetate,oxytol acetate,ethylglycol acetate,ethyl cellosolve acetate,1-acetoxy-2-ethoxyethane,ethylglykolacetat,octan etoksyetylu |
| IUPAC Name | 2-ethoxyethyl acetate |
| InChI Key | SVONRAPFKPVNKG-UHFFFAOYSA-N |
| Molecular Formula | C6H12O3 |
5-Norbornen-2-methanol (mixture of isomers) 98.0+%, TCI America™
CAS: 95-12-5 Molecular Formula: C8H12O Molecular Weight (g/mol): 124.183 MDL Number: MFCD00167571 InChI Key: LUMNWCHHXDUKFI-UHFFFAOYSA-N Synonym: 5-norbornene-2-methanol,bicyclo 2.2.1 hept-5-en-2-ylmethanol,bicyclo 2.2.1 hept-5-ene-2-methanol,cyclol,2-hydroxymethyl-5-norbornene,5-hydroxymethyl-2-norbornene,5-norbornene 2-methanol,5-hydroxymethylbicyclo 2.2.1 hept-2-ene,2-hydroxymethyl bicyclo 2.2.1 hept-5-ene PubChem CID: 78946 IUPAC Name: 5-bicyclo[2.2.1]hept-2-enylmethanol SMILES: C1C2CC(C1C=C2)CO
| PubChem CID | 78946 |
|---|---|
| CAS | 95-12-5 |
| Molecular Weight (g/mol) | 124.183 |
| MDL Number | MFCD00167571 |
| SMILES | C1C2CC(C1C=C2)CO |
| Synonym | 5-norbornene-2-methanol,bicyclo 2.2.1 hept-5-en-2-ylmethanol,bicyclo 2.2.1 hept-5-ene-2-methanol,cyclol,2-hydroxymethyl-5-norbornene,5-hydroxymethyl-2-norbornene,5-norbornene 2-methanol,5-hydroxymethylbicyclo 2.2.1 hept-2-ene,2-hydroxymethyl bicyclo 2.2.1 hept-5-ene |
| IUPAC Name | 5-bicyclo[2.2.1]hept-2-enylmethanol |
| InChI Key | LUMNWCHHXDUKFI-UHFFFAOYSA-N |
| Molecular Formula | C8H12O |
Ethyl 3-Methyl-3-phenylglycidate (mixture of isomers) 95.0+%, TCI America™
CAS: 77-83-8 Molecular Formula: C12H14O3 Molecular Weight (g/mol): 206.241 MDL Number: MFCD00022338 InChI Key: LQKRYVGRPXFFAV-UHFFFAOYSA-N Synonym: ethyl methylphenylglycidate,ethyl 3-methyl-3-phenylglycidate,strawberry aldehyde,fraeseol,empg,c-16 aldehyde,aldehyde c-16,ethyl methylphenyl glycidate,ethyl-3-methyl-3-phenylglycidate,ethyl 2,3-epoxy-3-phenylbutyrate PubChem CID: 6501 IUPAC Name: ethyl 3-methyl-3-phenyloxirane-2-carboxylate SMILES: CCOC(=O)C1C(O1)(C)C2=CC=CC=C2
| PubChem CID | 6501 |
|---|---|
| CAS | 77-83-8 |
| Molecular Weight (g/mol) | 206.241 |
| MDL Number | MFCD00022338 |
| SMILES | CCOC(=O)C1C(O1)(C)C2=CC=CC=C2 |
| Synonym | ethyl methylphenylglycidate,ethyl 3-methyl-3-phenylglycidate,strawberry aldehyde,fraeseol,empg,c-16 aldehyde,aldehyde c-16,ethyl methylphenyl glycidate,ethyl-3-methyl-3-phenylglycidate,ethyl 2,3-epoxy-3-phenylbutyrate |
| IUPAC Name | ethyl 3-methyl-3-phenyloxirane-2-carboxylate |
| InChI Key | LQKRYVGRPXFFAV-UHFFFAOYSA-N |
| Molecular Formula | C12H14O3 |
4-(Trifluoromethyl)cyclohexanemethanol (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 883731-58-6 Molecular Formula: C8H13F3O Molecular Weight (g/mol): 182.19 MDL Number: MFCD21324328,MFCD29054589 InChI Key: DYUAPKHFRXRMTL-UHFFFAOYSA-N PubChem CID: 44228198 IUPAC Name: [4-(trifluoromethyl)cyclohexyl]methanol SMILES: OCC1CCC(CC1)C(F)(F)F
| PubChem CID | 44228198 |
|---|---|
| CAS | 883731-58-6 |
| Molecular Weight (g/mol) | 182.19 |
| MDL Number | MFCD21324328,MFCD29054589 |
| SMILES | OCC1CCC(CC1)C(F)(F)F |
| IUPAC Name | [4-(trifluoromethyl)cyclohexyl]methanol |
| InChI Key | DYUAPKHFRXRMTL-UHFFFAOYSA-N |
| Molecular Formula | C8H13F3O |
Benzyl 4-Hydroxyphenyl Ketone 98.0+%, TCI America™
CAS: 2491-32-9 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.248 MDL Number: MFCD00002360 InChI Key: JBQTZLNCDIFCCO-UHFFFAOYSA-N Synonym: benzyl 4-hydroxyphenyl ketone,1-4-hydroxyphenyl-2-phenylethanone,4-hydroxydeoxybenzoin,acetophenone, 4'-hydroxy-2-phenyl,1-4-hydroxyphenyl-2-phenylethan-1-one,ethanone, 1-4-hydroxyphenyl-2-phenyl,acmc-20alpm,4-hydroxydesoxybenzoin,p-phenylacetyl phenol,maybridge3_000426 PubChem CID: 75607 IUPAC Name: 1-(4-hydroxyphenyl)-2-phenylethanone SMILES: C1=CC=C(C=C1)CC(=O)C2=CC=C(C=C2)O
| PubChem CID | 75607 |
|---|---|
| CAS | 2491-32-9 |
| Molecular Weight (g/mol) | 212.248 |
| MDL Number | MFCD00002360 |
| SMILES | C1=CC=C(C=C1)CC(=O)C2=CC=C(C=C2)O |
| Synonym | benzyl 4-hydroxyphenyl ketone,1-4-hydroxyphenyl-2-phenylethanone,4-hydroxydeoxybenzoin,acetophenone, 4'-hydroxy-2-phenyl,1-4-hydroxyphenyl-2-phenylethan-1-one,ethanone, 1-4-hydroxyphenyl-2-phenyl,acmc-20alpm,4-hydroxydesoxybenzoin,p-phenylacetyl phenol,maybridge3_000426 |
| IUPAC Name | 1-(4-hydroxyphenyl)-2-phenylethanone |
| InChI Key | JBQTZLNCDIFCCO-UHFFFAOYSA-N |
| Molecular Formula | C14H12O2 |
1,1,3,3-Tetrabromoacetone 98.0+%, TCI America™
CAS: 22612-89-1 Molecular Formula: C3H2Br4O Molecular Weight (g/mol): 373.664 MDL Number: MFCD00059470 InChI Key: SAMNBOHOBWEEEU-UHFFFAOYSA-N Synonym: 1,1,3,3-Tetrabromo-2-propanone PubChem CID: 608441 IUPAC Name: 1,1,3,3-tetrabromopropan-2-one SMILES: C(C(=O)C(Br)Br)(Br)Br
| PubChem CID | 608441 |
|---|---|
| CAS | 22612-89-1 |
| Molecular Weight (g/mol) | 373.664 |
| MDL Number | MFCD00059470 |
| SMILES | C(C(=O)C(Br)Br)(Br)Br |
| Synonym | 1,1,3,3-Tetrabromo-2-propanone |
| IUPAC Name | 1,1,3,3-tetrabromopropan-2-one |
| InChI Key | SAMNBOHOBWEEEU-UHFFFAOYSA-N |
| Molecular Formula | C3H2Br4O |
2',4',6'-Trihydroxypropiophenone 98.0+%, TCI America™
CAS: 2295-58-1 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00016456 InChI Key: PTHLEKANMPKYDB-UHFFFAOYSA-N Synonym: Flopropione, Phlopropiophenone PubChem CID: 3362 IUPAC Name: 1-(2,4,6-trihydroxyphenyl)propan-1-one SMILES: CCC(=O)C1=C(O)C=C(O)C=C1O
| PubChem CID | 3362 |
|---|---|
| CAS | 2295-58-1 |
| Molecular Weight (g/mol) | 182.18 |
| MDL Number | MFCD00016456 |
| SMILES | CCC(=O)C1=C(O)C=C(O)C=C1O |
| Synonym | Flopropione, Phlopropiophenone |
| IUPAC Name | 1-(2,4,6-trihydroxyphenyl)propan-1-one |
| InChI Key | PTHLEKANMPKYDB-UHFFFAOYSA-N |
| Molecular Formula | C9H10O4 |
4-Propoxybenzaldehyde 97.0+%, TCI America™
CAS: 5736-85-6 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00014134 InChI Key: FGXZWMCBNMMYPL-UHFFFAOYSA-N Synonym: p-propoxybenzaldehyde,benzaldehyde, 4-propoxy,4-n-propoxybenzaldehyde,propoxybenzaldehyde,benzaldehyde, p-propoxy,p-n-propoxy benzaldehyde,p-n-propoxybenzaldehyde,4-propoxybenzaldehyde,4-n-propyloxybenzaldehyde,wln: vhr do3 PubChem CID: 79812 IUPAC Name: 4-propoxybenzaldehyde SMILES: CCCOC1=CC=C(C=C1)C=O
| PubChem CID | 79812 |
|---|---|
| CAS | 5736-85-6 |
| Molecular Weight (g/mol) | 164.204 |
| MDL Number | MFCD00014134 |
| SMILES | CCCOC1=CC=C(C=C1)C=O |
| Synonym | p-propoxybenzaldehyde,benzaldehyde, 4-propoxy,4-n-propoxybenzaldehyde,propoxybenzaldehyde,benzaldehyde, p-propoxy,p-n-propoxy benzaldehyde,p-n-propoxybenzaldehyde,4-propoxybenzaldehyde,4-n-propyloxybenzaldehyde,wln: vhr do3 |
| IUPAC Name | 4-propoxybenzaldehyde |
| InChI Key | FGXZWMCBNMMYPL-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
Atrolactic Acid Hydrate 98.0+%, TCI America™
CAS: 515-30-0 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00004451 InChI Key: NWCHELUCVWSRRS-UHFFFAOYSA-N Synonym: atrolactic acid,2-phenyllactic acid,2-hydroxy-2-phenylpropionic acid,alpha-methylmandelic acid,phenyllactic acid,2-phenyl-2-hydroxypropionic acid,dl-atrolactic acid,alpha-hydroxy-alpha-phenylpropionic acid,mandelic acid, .alpha.-methyl,benzeneacetic acid, .alpha.-hydroxy-.alpha.-methyl PubChem CID: 1303 ChEBI: CHEBI:50392 IUPAC Name: 2-hydroxy-2-phenylpropanoic acid SMILES: CC(C1=CC=CC=C1)(C(=O)O)O
| PubChem CID | 1303 |
|---|---|
| CAS | 515-30-0 |
| Molecular Weight (g/mol) | 166.176 |
| ChEBI | CHEBI:50392 |
| MDL Number | MFCD00004451 |
| SMILES | CC(C1=CC=CC=C1)(C(=O)O)O |
| Synonym | atrolactic acid,2-phenyllactic acid,2-hydroxy-2-phenylpropionic acid,alpha-methylmandelic acid,phenyllactic acid,2-phenyl-2-hydroxypropionic acid,dl-atrolactic acid,alpha-hydroxy-alpha-phenylpropionic acid,mandelic acid, .alpha.-methyl,benzeneacetic acid, .alpha.-hydroxy-.alpha.-methyl |
| IUPAC Name | 2-hydroxy-2-phenylpropanoic acid |
| InChI Key | NWCHELUCVWSRRS-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
1-Phenylcyclohexanol 98.0+%, TCI America™
CAS: 1589-60-2 Molecular Formula: C12H16O Molecular Weight (g/mol): 176.259 MDL Number: MFCD00021393 InChI Key: DTTDXHDYTWQDCS-UHFFFAOYSA-N Synonym: 1-phenylcyclohexanol,cyclohexanol, 1-phenyl,1-phenyl-1-cyclohexanol,phenylcyclohexanol,cyclohexanol, phenyl,1-phenylcyclohexanol-1,1-phenyl-cyclohexanol,maybridge1_002485,1-phenyl-cyclohexan-1-ol,acmc-209dj8 PubChem CID: 15319 IUPAC Name: 1-phenylcyclohexan-1-ol SMILES: C1CCC(CC1)(C2=CC=CC=C2)O
| PubChem CID | 15319 |
|---|---|
| CAS | 1589-60-2 |
| Molecular Weight (g/mol) | 176.259 |
| MDL Number | MFCD00021393 |
| SMILES | C1CCC(CC1)(C2=CC=CC=C2)O |
| Synonym | 1-phenylcyclohexanol,cyclohexanol, 1-phenyl,1-phenyl-1-cyclohexanol,phenylcyclohexanol,cyclohexanol, phenyl,1-phenylcyclohexanol-1,1-phenyl-cyclohexanol,maybridge1_002485,1-phenyl-cyclohexan-1-ol,acmc-209dj8 |
| IUPAC Name | 1-phenylcyclohexan-1-ol |
| InChI Key | DTTDXHDYTWQDCS-UHFFFAOYSA-N |
| Molecular Formula | C12H16O |