Organooxygen compounds
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5-Methoxy-2-(trifluoromethyl)pyridine, 97%
CAS: 216766-13-1 Molecular Formula: C7H6F3NO Molecular Weight (g/mol): 177.13 MDL Number: MFCD09864699 InChI Key: MRHJZBSCOLVMGA-UHFFFAOYSA-N Synonym: 5-methoxy-2-trifluoromethyl pyridine,5-methoxy-2-trifluoromethyl-pyridine,pubchem23560,3-methoxy-6-trifluoromethylpyridine,3-methoxy-6-trifluoromethyl pyridine,pyridine,5-methoxy-2-trifluoromethyl PubChem CID: 22000196 IUPAC Name: 5-methoxy-2-(trifluoromethyl)pyridine SMILES: COC1=CN=C(C=C1)C(F)(F)F
| PubChem CID | 22000196 |
|---|---|
| CAS | 216766-13-1 |
| Molecular Weight (g/mol) | 177.13 |
| MDL Number | MFCD09864699 |
| SMILES | COC1=CN=C(C=C1)C(F)(F)F |
| Synonym | 5-methoxy-2-trifluoromethyl pyridine,5-methoxy-2-trifluoromethyl-pyridine,pubchem23560,3-methoxy-6-trifluoromethylpyridine,3-methoxy-6-trifluoromethyl pyridine,pyridine,5-methoxy-2-trifluoromethyl |
| IUPAC Name | 5-methoxy-2-(trifluoromethyl)pyridine |
| InChI Key | MRHJZBSCOLVMGA-UHFFFAOYSA-N |
| Molecular Formula | C7H6F3NO |
4-Hydroxy-2(5H)-furanone, 95%
CAS: 541-57-1 Molecular Formula: C4H4O3 Molecular Weight (g/mol): 100.07 MDL Number: MFCD00052187 InChI Key: JZQBAGOECGRTSA-UHFFFAOYSA-N Synonym: 4-hydroxyfuran-2 5h-one,4-hydroxy-2,5-dihydrofuran-2-one,4-hydroxy-2 5h-furanone,2 5h-furanone, 4-hydroxy,4-hydroxy-5h-furan-2-one,5-hydroxyfuran-3-one,5-hydroxyfuran-3 2h-one,pubchem21770,acmc-209xna,tetronic acid 5g PubChem CID: 54683813 IUPAC Name: 3-hydroxy-2H-furan-5-one SMILES: OC1=CC(=O)OC1
| PubChem CID | 54683813 |
|---|---|
| CAS | 541-57-1 |
| Molecular Weight (g/mol) | 100.07 |
| MDL Number | MFCD00052187 |
| SMILES | OC1=CC(=O)OC1 |
| Synonym | 4-hydroxyfuran-2 5h-one,4-hydroxy-2,5-dihydrofuran-2-one,4-hydroxy-2 5h-furanone,2 5h-furanone, 4-hydroxy,4-hydroxy-5h-furan-2-one,5-hydroxyfuran-3-one,5-hydroxyfuran-3 2h-one,pubchem21770,acmc-209xna,tetronic acid 5g |
| IUPAC Name | 3-hydroxy-2H-furan-5-one |
| InChI Key | JZQBAGOECGRTSA-UHFFFAOYSA-N |
| Molecular Formula | C4H4O3 |
1-(4-Methylphenyl)ethanol, 97%
CAS: 536-50-5 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00016860 InChI Key: JESIHYIJKKUWIS-UHFFFAOYSA-N Synonym: 1-4-methylphenyl ethanol,1-p-tolyl ethanol,bilagen,galinex,norbilan,tomobil,methyl-p-tolylcarbinol,p-tolylmethylcarbinol,1-4-tolyl ethanol,1-p-tolyl-1-ethanol PubChem CID: 10817 IUPAC Name: 1-(4-methylphenyl)ethanol SMILES: CC1=CC=C(C=C1)C(C)O
| PubChem CID | 10817 |
|---|---|
| CAS | 536-50-5 |
| Molecular Weight (g/mol) | 136.194 |
| MDL Number | MFCD00016860 |
| SMILES | CC1=CC=C(C=C1)C(C)O |
| Synonym | 1-4-methylphenyl ethanol,1-p-tolyl ethanol,bilagen,galinex,norbilan,tomobil,methyl-p-tolylcarbinol,p-tolylmethylcarbinol,1-4-tolyl ethanol,1-p-tolyl-1-ethanol |
| IUPAC Name | 1-(4-methylphenyl)ethanol |
| InChI Key | JESIHYIJKKUWIS-UHFFFAOYSA-N |
| Molecular Formula | C9H12O |
L-Ascorbic Acid, TraceSELECT™, ≥99.0% (RT), Honeywell™ Fluka™
CAS: 50-81-7 Molecular Formula: C6H8O6 Molecular Weight (g/mol): 176.12 MDL Number: MFCD00064328 InChI Key: CIWBSHSKHKDKBQ-DOMZIZNONA-N Synonym: l-ascorbic acid,ascorbic acid,vitamin c,l-ascorbate,ascorbate,ascorbicap,l +-ascorbic acid,cevitamic acid,ascoltin,hybrin PubChem CID: 54670067 ChEBI: CHEBI:29073 IUPAC Name: (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one SMILES: OC[C@H](O)[C@H]1OC(=O)C(O)=C1O
| PubChem CID | 54670067 |
|---|---|
| CAS | 50-81-7 |
| Molecular Weight (g/mol) | 176.12 |
| ChEBI | CHEBI:29073 |
| MDL Number | MFCD00064328 |
| SMILES | OC[C@H](O)[C@H]1OC(=O)C(O)=C1O |
| Synonym | l-ascorbic acid,ascorbic acid,vitamin c,l-ascorbate,ascorbate,ascorbicap,l +-ascorbic acid,cevitamic acid,ascoltin,hybrin |
| IUPAC Name | (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one |
| InChI Key | CIWBSHSKHKDKBQ-DOMZIZNONA-N |
| Molecular Formula | C6H8O6 |
2-Bromo-4'-methylpropiophenone, 98%
CAS: 1451-82-7 Molecular Formula: C10H11BrO Molecular Weight (g/mol): 227.10 MDL Number: MFCD11131402 InChI Key: OZLUPIIIHOOPNQ-UHFFFAOYNA-N Synonym: 2-bromo-1-p-tolyl propan-1-one,2-bromo-4'-methylpropiophenone,2-bromo-1-4-methylphenyl propan-1-one,2-bromo-4-methylpropiophenone,2-bromo-1-4-methylphenyl-1-propanone,1-propanone, 2-bromo-1-4-methylphenyl,2-bromo-1-p-tolylpropan-1-one,ksc917e0p,2-bromo-1-p-tolyl-propan-1-one,4'-methyl-alpha-bromopropiophenone PubChem CID: 2734063 IUPAC Name: 2-bromo-1-(4-methylphenyl)propan-1-one SMILES: CC(Br)C(=O)C1=CC=C(C)C=C1
| PubChem CID | 2734063 |
|---|---|
| CAS | 1451-82-7 |
| Molecular Weight (g/mol) | 227.10 |
| MDL Number | MFCD11131402 |
| SMILES | CC(Br)C(=O)C1=CC=C(C)C=C1 |
| Synonym | 2-bromo-1-p-tolyl propan-1-one,2-bromo-4'-methylpropiophenone,2-bromo-1-4-methylphenyl propan-1-one,2-bromo-4-methylpropiophenone,2-bromo-1-4-methylphenyl-1-propanone,1-propanone, 2-bromo-1-4-methylphenyl,2-bromo-1-p-tolylpropan-1-one,ksc917e0p,2-bromo-1-p-tolyl-propan-1-one,4'-methyl-alpha-bromopropiophenone |
| IUPAC Name | 2-bromo-1-(4-methylphenyl)propan-1-one |
| InChI Key | OZLUPIIIHOOPNQ-UHFFFAOYNA-N |
| Molecular Formula | C10H11BrO |
2-Methylbutyraldehyde, 95%
CAS: 96-17-3 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00006984 InChI Key: BYGQBDHUGHBGMD-UHFFFAOYNA-N Synonym: 2-methylbutyraldehyde,butanal, 2-methyl,2-formylbutane,2-methylbutyric aldehyde,methylethylacetaldehyde,2-ethylpropanal,2-methyl-1-butanal,butyraldehyde, 2-methyl,acetaldehyde, ethylmethyl,alpha-methylbutanal PubChem CID: 7284 ChEBI: CHEBI:16182 IUPAC Name: 2-methylbutanal SMILES: CCC(C)C=O
| PubChem CID | 7284 |
|---|---|
| CAS | 96-17-3 |
| Molecular Weight (g/mol) | 86.13 |
| ChEBI | CHEBI:16182 |
| MDL Number | MFCD00006984 |
| SMILES | CCC(C)C=O |
| Synonym | 2-methylbutyraldehyde,butanal, 2-methyl,2-formylbutane,2-methylbutyric aldehyde,methylethylacetaldehyde,2-ethylpropanal,2-methyl-1-butanal,butyraldehyde, 2-methyl,acetaldehyde, ethylmethyl,alpha-methylbutanal |
| IUPAC Name | 2-methylbutanal |
| InChI Key | BYGQBDHUGHBGMD-UHFFFAOYNA-N |
| Molecular Formula | C5H10O |
5-Methoxy-1-indanone, 98%
CAS: 5111-70-6 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00003789 InChI Key: QOPRWBRNMPANKN-UHFFFAOYSA-N Synonym: 5-methoxy-1-indanone,5-methoxyindan-1-one,5-methoxy-2,3-dihydro-1h-inden-1-one,5-methoxyindanone,2,3-dihydro-5-methoxyinden-1-one,1h-inden-1-one, 2,3-dihydro-5-methoxy,5-methoxy indanone,5-methoxyhydrindone,pubchem2031,1-oxo-5-methoxyindane PubChem CID: 78787 IUPAC Name: 5-methoxy-2,3-dihydroinden-1-one SMILES: COC1=CC2=C(C=C1)C(=O)CC2
| PubChem CID | 78787 |
|---|---|
| CAS | 5111-70-6 |
| Molecular Weight (g/mol) | 162.188 |
| MDL Number | MFCD00003789 |
| SMILES | COC1=CC2=C(C=C1)C(=O)CC2 |
| Synonym | 5-methoxy-1-indanone,5-methoxyindan-1-one,5-methoxy-2,3-dihydro-1h-inden-1-one,5-methoxyindanone,2,3-dihydro-5-methoxyinden-1-one,1h-inden-1-one, 2,3-dihydro-5-methoxy,5-methoxy indanone,5-methoxyhydrindone,pubchem2031,1-oxo-5-methoxyindane |
| IUPAC Name | 5-methoxy-2,3-dihydroinden-1-one |
| InChI Key | QOPRWBRNMPANKN-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |
(S)-(-)-1-Phenylethanol, 97+%
CAS: 1445-91-6 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.17 MDL Number: MFCD00064264 InChI Key: WAPNOHKVXSQRPX-ZETCQYMHSA-N PubChem CID: 443135 ChEBI: CHEBI:16346 SMILES: C[C@H](O)C1=CC=CC=C1
| PubChem CID | 443135 |
|---|---|
| CAS | 1445-91-6 |
| Molecular Weight (g/mol) | 122.17 |
| ChEBI | CHEBI:16346 |
| MDL Number | MFCD00064264 |
| SMILES | C[C@H](O)C1=CC=CC=C1 |
| InChI Key | WAPNOHKVXSQRPX-ZETCQYMHSA-N |
| Molecular Formula | C8H10O |
1-(4-Methoxyphenyl)ethanol, 95%
CAS: 3319-15-1 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00016857,MFCD09863666,MFCD09863667 InChI Key: IUUULXXWNYKJSL-UHFFFAOYNA-N Synonym: 1-4-methoxyphenyl ethanol,1-4-methoxyphenyl ethan-1-ol,4-methoxy-alpha-methylbenzyl alcohol,4-methoxyphenyl methyl carbinol,1-p-methoxyphenyl ethanol,4-methoxy-.alpha.-methylbenzyl alcohol,1-4-methoxyphenyl-ethanol,acmc-20apae,4-methoxyphenyl ethanol,1 p-methoxyphenyl ethanol PubChem CID: 101148 ChEBI: CHEBI:86566 IUPAC Name: 1-(4-methoxyphenyl)ethanol SMILES: COC1=CC=C(C=C1)C(C)O
| PubChem CID | 101148 |
|---|---|
| CAS | 3319-15-1 |
| Molecular Weight (g/mol) | 152.19 |
| ChEBI | CHEBI:86566 |
| MDL Number | MFCD00016857,MFCD09863666,MFCD09863667 |
| SMILES | COC1=CC=C(C=C1)C(C)O |
| Synonym | 1-4-methoxyphenyl ethanol,1-4-methoxyphenyl ethan-1-ol,4-methoxy-alpha-methylbenzyl alcohol,4-methoxyphenyl methyl carbinol,1-p-methoxyphenyl ethanol,4-methoxy-.alpha.-methylbenzyl alcohol,1-4-methoxyphenyl-ethanol,acmc-20apae,4-methoxyphenyl ethanol,1 p-methoxyphenyl ethanol |
| IUPAC Name | 1-(4-methoxyphenyl)ethanol |
| InChI Key | IUUULXXWNYKJSL-UHFFFAOYNA-N |
| Molecular Formula | C9H12O2 |
(R)-(-)-2-Methyl-2,4-pentanediol, 98+%
CAS: 99210-90-9 Molecular Formula: C6H14O2 Molecular Weight (g/mol): 118.18 MDL Number: MFCD00064275 InChI Key: SVTBMSDMJJWYQN-UHFFFAOYNA-N Synonym: 4r-2-methylpentane-2,4-diol,r---2-methyl-2,4-pentanediol,mrd,2-methylpentan-2,4-diol,r-2-methyl-2,4-pentanediol,1hty,r-mpd,4-methyl-2,4-pentanediole,r---2-methyl-2,4-pentandiol,.+/-.-2-methyl-2,4-pentanediol PubChem CID: 5288845 IUPAC Name: (4R)-2-methylpentane-2,4-diol SMILES: CC(O)CC(C)(C)O
| PubChem CID | 5288845 |
|---|---|
| CAS | 99210-90-9 |
| Molecular Weight (g/mol) | 118.18 |
| MDL Number | MFCD00064275 |
| SMILES | CC(O)CC(C)(C)O |
| Synonym | 4r-2-methylpentane-2,4-diol,r---2-methyl-2,4-pentanediol,mrd,2-methylpentan-2,4-diol,r-2-methyl-2,4-pentanediol,1hty,r-mpd,4-methyl-2,4-pentanediole,r---2-methyl-2,4-pentandiol,.+/-.-2-methyl-2,4-pentanediol |
| IUPAC Name | (4R)-2-methylpentane-2,4-diol |
| InChI Key | SVTBMSDMJJWYQN-UHFFFAOYNA-N |
| Molecular Formula | C6H14O2 |
2-Bromo-2'-methoxyacetophenone, 98%
CAS: 31949-21-0 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00000196 InChI Key: GKNCPTLOPRDYMH-UHFFFAOYSA-N Synonym: 2-bromo-1-2-methoxyphenyl ethanone,2-bromo-2'-methoxyacetophenone,2-methoxyphenacyl bromide,o-methoxy phenacylbromide,bromomethyl 2-methoxyphenyl ketone,2-bromo-1-2-methoxyphenyl ethan-1-one,2-bromo-2'-methoxy acetophenone,ethanone, 2-bromo-1-methoxyphenyl,alpha-bromo-o-methoxyacetophenone,2-bromoacetylanisole PubChem CID: 123440 IUPAC Name: 2-bromo-1-(2-methoxyphenyl)ethanone SMILES: COC1=CC=CC=C1C(=O)CBr
| PubChem CID | 123440 |
|---|---|
| CAS | 31949-21-0 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD00000196 |
| SMILES | COC1=CC=CC=C1C(=O)CBr |
| Synonym | 2-bromo-1-2-methoxyphenyl ethanone,2-bromo-2'-methoxyacetophenone,2-methoxyphenacyl bromide,o-methoxy phenacylbromide,bromomethyl 2-methoxyphenyl ketone,2-bromo-1-2-methoxyphenyl ethan-1-one,2-bromo-2'-methoxy acetophenone,ethanone, 2-bromo-1-methoxyphenyl,alpha-bromo-o-methoxyacetophenone,2-bromoacetylanisole |
| IUPAC Name | 2-bromo-1-(2-methoxyphenyl)ethanone |
| InChI Key | GKNCPTLOPRDYMH-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
4,4,4-Trifluoro-1-(2-furyl)-1,3-butanedione, 98%
CAS: 326-90-9 Molecular Formula: C8H5F3O3 Molecular Weight (g/mol): 206.12 MDL Number: MFCD00020935 InChI Key: OWLPCALGCHDBCN-UHFFFAOYSA-N Synonym: 4,4,4-trifluoro-1-furan-2-yl butane-1,3-dione,2-furoyltrifluoroacetone,furoyltrifluoroacetone,4,4,4-trifluoro-1-2-furyl-1,3-butanedione,perfluoroacetyl 2-furoyl methane,furonyltrifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-furanyl,4,4,4-trifluoro-1-2-furyl butane-1,3-dione,2-furoyl trifluoro acetone,4,4,4-trifluoro-1-2-furanyl-1,3-butanedione PubChem CID: 67594 IUPAC Name: 4,4,4-trifluoro-1-(furan-2-yl)butane-1,3-dione SMILES: FC(F)(F)C(=O)CC(=O)C1=CC=CO1
| PubChem CID | 67594 |
|---|---|
| CAS | 326-90-9 |
| Molecular Weight (g/mol) | 206.12 |
| MDL Number | MFCD00020935 |
| SMILES | FC(F)(F)C(=O)CC(=O)C1=CC=CO1 |
| Synonym | 4,4,4-trifluoro-1-furan-2-yl butane-1,3-dione,2-furoyltrifluoroacetone,furoyltrifluoroacetone,4,4,4-trifluoro-1-2-furyl-1,3-butanedione,perfluoroacetyl 2-furoyl methane,furonyltrifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-furanyl,4,4,4-trifluoro-1-2-furyl butane-1,3-dione,2-furoyl trifluoro acetone,4,4,4-trifluoro-1-2-furanyl-1,3-butanedione |
| IUPAC Name | 4,4,4-trifluoro-1-(furan-2-yl)butane-1,3-dione |
| InChI Key | OWLPCALGCHDBCN-UHFFFAOYSA-N |
| Molecular Formula | C8H5F3O3 |
Methyl 4-formylbenzoate, 98+%
CAS: 1571-08-0 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00006950 InChI Key: FEIOASZZURHTHB-UHFFFAOYSA-N Synonym: methyl p-formylbenzoate,4-carbomethoxybenzaldehyde,methyl terephthalaldehydate,4-methoxycarbonyl benzaldehyde,benzoic acid, 4-formyl-, methyl ester,p-carbomethoxybenzaldehyde,methyl terephthaldehydate,methyl4-formylbenzoate,4-formylbenzoic acid methyl ester,methyl-p-formyl benzoate PubChem CID: 15294 IUPAC Name: methyl 4-formylbenzoate SMILES: COC(=O)C1=CC=C(C=O)C=C1
| PubChem CID | 15294 |
|---|---|
| CAS | 1571-08-0 |
| Molecular Weight (g/mol) | 164.16 |
| MDL Number | MFCD00006950 |
| SMILES | COC(=O)C1=CC=C(C=O)C=C1 |
| Synonym | methyl p-formylbenzoate,4-carbomethoxybenzaldehyde,methyl terephthalaldehydate,4-methoxycarbonyl benzaldehyde,benzoic acid, 4-formyl-, methyl ester,p-carbomethoxybenzaldehyde,methyl terephthaldehydate,methyl4-formylbenzoate,4-formylbenzoic acid methyl ester,methyl-p-formyl benzoate |
| IUPAC Name | methyl 4-formylbenzoate |
| InChI Key | FEIOASZZURHTHB-UHFFFAOYSA-N |
| Molecular Formula | C9H8O3 |
Chloroacetone, 96%, stabilized
CAS: 78-95-5 Molecular Formula: C3H5ClO Molecular Weight (g/mol): 92.52 MDL Number: MFCD00000936 InChI Key: BULLHNJGPPOUOX-UHFFFAOYSA-N Synonym: chloroacetone,chloropropanone,acetonyl chloride,monochloroacetone,tonite,2-propanone, 1-chloro,chloro-2-propanone,1-chloroacetone,chloromethyl methyl ketone,1-chloro-2-propanone PubChem CID: 6571 ChEBI: CHEBI:47220 IUPAC Name: 1-chloropropan-2-one SMILES: CC(=O)CCl
| PubChem CID | 6571 |
|---|---|
| CAS | 78-95-5 |
| Molecular Weight (g/mol) | 92.52 |
| ChEBI | CHEBI:47220 |
| MDL Number | MFCD00000936 |
| SMILES | CC(=O)CCl |
| Synonym | chloroacetone,chloropropanone,acetonyl chloride,monochloroacetone,tonite,2-propanone, 1-chloro,chloro-2-propanone,1-chloroacetone,chloromethyl methyl ketone,1-chloro-2-propanone |
| IUPAC Name | 1-chloropropan-2-one |
| InChI Key | BULLHNJGPPOUOX-UHFFFAOYSA-N |
| Molecular Formula | C3H5ClO |
Propylene Glycol, USP, 99.5%, Spectrum™ Chemical
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CAS: 57-55-6 Molecular Formula: C3H8O2 Molecular Weight (g/mol): 76.10 InChI Key: DNIAPMSPPWPWGF-UHFFFAOYNA-N IUPAC Name: propane-1,2-diol SMILES: CC(O)CO
| CAS | 57-55-6 |
|---|---|
| Molecular Weight (g/mol) | 76.10 |
| SMILES | CC(O)CO |
| IUPAC Name | propane-1,2-diol |
| InChI Key | DNIAPMSPPWPWGF-UHFFFAOYNA-N |
| Molecular Formula | C3H8O2 |