Organooxygen compounds
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2-Mercaptoethanol, 98+%
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 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 |
| InChI Key | DGVVWUTYPXICAM-UHFFFAOYSA-N |
| Molecular Formula | C2H6OS |
1-Eicosanol, 98%
CAS: 629-96-9 Molecular Formula: C20H42O Molecular Weight (g/mol): 298.56 MDL Number: MFCD00002938 InChI Key: BTFJIXJJCSYFAL-UHFFFAOYSA-N Synonym: 1-eicosanol,arachidyl alcohol,n-eicosanol,arachidic alcohol,arachic alcohol,eicosyl alcohol,eicosan-1-ol,eicosanol,1-icosanol,n-1-eicosanol PubChem CID: 12404 ChEBI: CHEBI:75627 IUPAC Name: icosan-1-ol SMILES: CCCCCCCCCCCCCCCCCCCCO
| PubChem CID | 12404 |
|---|---|
| CAS | 629-96-9 |
| Molecular Weight (g/mol) | 298.56 |
| ChEBI | CHEBI:75627 |
| MDL Number | MFCD00002938 |
| SMILES | CCCCCCCCCCCCCCCCCCCCO |
| Synonym | 1-eicosanol,arachidyl alcohol,n-eicosanol,arachidic alcohol,arachic alcohol,eicosyl alcohol,eicosan-1-ol,eicosanol,1-icosanol,n-1-eicosanol |
| IUPAC Name | icosan-1-ol |
| InChI Key | BTFJIXJJCSYFAL-UHFFFAOYSA-N |
| Molecular Formula | C20H42O |
Titanium(IV) n-butoxide, 98+%
CAS: 5593-70-4 Molecular Formula: C16H36O4Ti Molecular Weight (g/mol): 340.35 MDL Number: MFCD00009433 InChI Key: FPCJKVGGYOAWIZ-UHFFFAOYSA-N Synonym: butyl titanate,butan-1-ol; titanium,titanium n-butoxide,tetrabutyl orthotitanate,tetrabutyl titanate,1-butanol; titanium,tetra butyl orthotitanate,tetrabutyl ortho-titanate PubChem CID: 25203927 IUPAC Name: butan-1-ol;titanium SMILES: CCCCO.CCCCO.CCCCO.CCCCO.[Ti]
| PubChem CID | 25203927 |
|---|---|
| CAS | 5593-70-4 |
| Molecular Weight (g/mol) | 340.35 |
| MDL Number | MFCD00009433 |
| SMILES | CCCCO.CCCCO.CCCCO.CCCCO.[Ti] |
| Synonym | butyl titanate,butan-1-ol; titanium,titanium n-butoxide,tetrabutyl orthotitanate,tetrabutyl titanate,1-butanol; titanium,tetra butyl orthotitanate,tetrabutyl ortho-titanate |
| IUPAC Name | butan-1-ol;titanium |
| InChI Key | FPCJKVGGYOAWIZ-UHFFFAOYSA-N |
| Molecular Formula | C16H36O4Ti |
(+/-)-2-Methyl-2,4-pentanediol, 98%
CAS: 107-41-5 Molecular Formula: C6H14O2 Molecular Weight (g/mol): 118.176 MDL Number: MFCD00004547 InChI Key: SVTBMSDMJJWYQN-UHFFFAOYSA-N Synonym: hexylene glycol,2-methyl-2,4-pentanediol,pinakon,2,4-dihydroxy-2-methylpentane,2,4-pentanediol, 2-methyl,diolane,isol,4-methyl-2,4-pentanediol,1,1,3-trimethyltrimethylenediol,2-methyl pentane-2,4-diol PubChem CID: 7870 ChEBI: CHEBI:62995 IUPAC Name: 2-methylpentane-2,4-diol SMILES: CC(CC(C)(C)O)O
| PubChem CID | 7870 |
|---|---|
| CAS | 107-41-5 |
| Molecular Weight (g/mol) | 118.176 |
| ChEBI | CHEBI:62995 |
| MDL Number | MFCD00004547 |
| SMILES | CC(CC(C)(C)O)O |
| Synonym | hexylene glycol,2-methyl-2,4-pentanediol,pinakon,2,4-dihydroxy-2-methylpentane,2,4-pentanediol, 2-methyl,diolane,isol,4-methyl-2,4-pentanediol,1,1,3-trimethyltrimethylenediol,2-methyl pentane-2,4-diol |
| IUPAC Name | 2-methylpentane-2,4-diol |
| InChI Key | SVTBMSDMJJWYQN-UHFFFAOYSA-N |
| Molecular Formula | C6H14O2 |
2-Fluoro-4-(trifluoromethoxy)benzaldehyde, 95%
CAS: 1227628-83-2 Molecular Formula: C8H4F4O2 Molecular Weight (g/mol): 208.112 MDL Number: MFCD16652440 InChI Key: DEACWPDDLIOZJV-UHFFFAOYSA-N Synonym: 2-fluoro-4-trifluoromethoxy benzaldehyde PubChem CID: 53465593 IUPAC Name: 2-fluoro-4-(trifluoromethoxy)benzaldehyde SMILES: C1=CC(=C(C=C1OC(F)(F)F)F)C=O
| PubChem CID | 53465593 |
|---|---|
| CAS | 1227628-83-2 |
| Molecular Weight (g/mol) | 208.112 |
| MDL Number | MFCD16652440 |
| SMILES | C1=CC(=C(C=C1OC(F)(F)F)F)C=O |
| Synonym | 2-fluoro-4-trifluoromethoxy benzaldehyde |
| IUPAC Name | 2-fluoro-4-(trifluoromethoxy)benzaldehyde |
| InChI Key | DEACWPDDLIOZJV-UHFFFAOYSA-N |
| Molecular Formula | C8H4F4O2 |
Methylglyoxal, MP Biomedicals™
CAS: 78-98-8 Molecular Formula: C3H4O2 Molecular Weight (g/mol): 72.06 MDL Number: MFCD00006960 InChI Key: AIJULSRZWUXGPQ-UHFFFAOYSA-N Synonym: methylglyoxal,pyruvaldehyde,pyruvic aldehyde,acetylformaldehyde,acetylformyl,propanal, 2-oxo,2-ketopropionaldehyde,propanedione,propanolone,methyl glyoxal PubChem CID: 880 ChEBI: CHEBI:17158 IUPAC Name: 2-oxopropanal SMILES: CC(=O)C=O
| PubChem CID | 880 |
|---|---|
| CAS | 78-98-8 |
| Molecular Weight (g/mol) | 72.06 |
| ChEBI | CHEBI:17158 |
| MDL Number | MFCD00006960 |
| SMILES | CC(=O)C=O |
| Synonym | methylglyoxal,pyruvaldehyde,pyruvic aldehyde,acetylformaldehyde,acetylformyl,propanal, 2-oxo,2-ketopropionaldehyde,propanedione,propanolone,methyl glyoxal |
| IUPAC Name | 2-oxopropanal |
| InChI Key | AIJULSRZWUXGPQ-UHFFFAOYSA-N |
| Molecular Formula | C3H4O2 |
2,2-Diethoxyacetophenone 95.0+%, TCI America™
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CAS: 6175-45-7 Molecular Formula: C12H16O3 Molecular Weight (g/mol): 208.26 MDL Number: MFCD00009659 InChI Key: PIZHFBODNLEQBL-UHFFFAOYSA-N Synonym: 2,2-diethoxyacetophenone,ethanone, 2,2-diethoxy-1-phenyl,phenylglyoxal diethyl acetal,2,2-diethoxy-1-phenylethan-1-one,alpha,alpha-diethoxyacetophenone,unii-w4bcz1mak3,2,2-diethoxy acetophenone,ccris 5222,benzoylformaldehyde diethyl acetal,glyoxal, phenyl-, 2-diethyl acetal PubChem CID: 22555 IUPAC Name: 2,2-diethoxy-1-phenylethan-1-one SMILES: CCOC(OCC)C(=O)C1=CC=CC=C1
| PubChem CID | 22555 |
|---|---|
| CAS | 6175-45-7 |
| Molecular Weight (g/mol) | 208.26 |
| MDL Number | MFCD00009659 |
| SMILES | CCOC(OCC)C(=O)C1=CC=CC=C1 |
| Synonym | 2,2-diethoxyacetophenone,ethanone, 2,2-diethoxy-1-phenyl,phenylglyoxal diethyl acetal,2,2-diethoxy-1-phenylethan-1-one,alpha,alpha-diethoxyacetophenone,unii-w4bcz1mak3,2,2-diethoxy acetophenone,ccris 5222,benzoylformaldehyde diethyl acetal,glyoxal, phenyl-, 2-diethyl acetal |
| IUPAC Name | 2,2-diethoxy-1-phenylethan-1-one |
| InChI Key | PIZHFBODNLEQBL-UHFFFAOYSA-N |
| Molecular Formula | C12H16O3 |
2-Methyl-1-propanol, 99+%, ACS reagent
CAS: 78-83-1 Molecular Formula: C4H10O Molecular Weight (g/mol): 74.12 MDL Number: MFCD00004740 InChI Key: ZXEKIIBDNHEJCQ-UHFFFAOYSA-N Synonym: 2-methyl-1-propanol,isobutanol,isobutyl alcohol,1-propanol, 2-methyl,1-hydroxymethylpropane,isopropylcarbinol,iso-butyl alcohol,2-methylpropyl alcohol,isobutylalkohol,i-butyl alcohol PubChem CID: 6560 ChEBI: CHEBI:46645 IUPAC Name: 2-methylpropan-1-ol SMILES: CC(C)CO
| PubChem CID | 6560 |
|---|---|
| CAS | 78-83-1 |
| Molecular Weight (g/mol) | 74.12 |
| ChEBI | CHEBI:46645 |
| MDL Number | MFCD00004740 |
| SMILES | CC(C)CO |
| Synonym | 2-methyl-1-propanol,isobutanol,isobutyl alcohol,1-propanol, 2-methyl,1-hydroxymethylpropane,isopropylcarbinol,iso-butyl alcohol,2-methylpropyl alcohol,isobutylalkohol,i-butyl alcohol |
| IUPAC Name | 2-methylpropan-1-ol |
| InChI Key | ZXEKIIBDNHEJCQ-UHFFFAOYSA-N |
| Molecular Formula | C4H10O |
Thermo Scientific Chemicals myo-Inositol, 98+%
CAS: 87-89-8 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00077932 InChI Key: CDAISMWEOUEBRE-UHFFFAOYSA-N Synonym: scyllo-inositol,myo-inositol,inositol,muco-inositol,epi-inositol,i-inositol,meso-inositol,allo-inositol,1d-chiro-inositol,myoinositol PubChem CID: 892 ChEBI: CHEBI:24848 IUPAC Name: cyclohexane-1,2,3,4,5,6-hexol SMILES: C1(C(C(C(C(C1O)O)O)O)O)O
| PubChem CID | 892 |
|---|---|
| CAS | 87-89-8 |
| Molecular Weight (g/mol) | 180.156 |
| ChEBI | CHEBI:24848 |
| MDL Number | MFCD00077932 |
| SMILES | C1(C(C(C(C(C1O)O)O)O)O)O |
| Synonym | scyllo-inositol,myo-inositol,inositol,muco-inositol,epi-inositol,i-inositol,meso-inositol,allo-inositol,1d-chiro-inositol,myoinositol |
| IUPAC Name | cyclohexane-1,2,3,4,5,6-hexol |
| InChI Key | CDAISMWEOUEBRE-UHFFFAOYSA-N |
| Molecular Formula | C6H12O6 |
2-Ethylhexanal, 96%
CAS: 123-05-7 Molecular Formula: C8H16O Molecular Weight (g/mol): 128.215 MDL Number: MFCD00006987 InChI Key: LGYNIFWIKSEESD-UHFFFAOYSA-N Synonym: hexanal, 2-ethyl,2-ethylhexaldehyde,2-ethylhexylaldehyde,3-formylheptane,2-ethylcaproaldehyde,butylethylacetaldehyde,ethylbutylacetaldehyde,ethylhexaldehyde,alpha-ethylcaproaldehyde,butyl ethyl acetaldehyde PubChem CID: 31241 IUPAC Name: 2-ethylhexanal SMILES: CCCCC(CC)C=O
| PubChem CID | 31241 |
|---|---|
| CAS | 123-05-7 |
| Molecular Weight (g/mol) | 128.215 |
| MDL Number | MFCD00006987 |
| SMILES | CCCCC(CC)C=O |
| Synonym | hexanal, 2-ethyl,2-ethylhexaldehyde,2-ethylhexylaldehyde,3-formylheptane,2-ethylcaproaldehyde,butylethylacetaldehyde,ethylbutylacetaldehyde,ethylhexaldehyde,alpha-ethylcaproaldehyde,butyl ethyl acetaldehyde |
| IUPAC Name | 2-ethylhexanal |
| InChI Key | LGYNIFWIKSEESD-UHFFFAOYSA-N |
| Molecular Formula | C8H16O |
o-Vanillin, 99%
CAS: 148-53-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00003322 InChI Key: JJVNINGBHGBWJH-UHFFFAOYSA-N Synonym: 3-methoxysalicylaldehyde,o-vanillin,6-formylguaiacol,2-vanillin,o-vanilline,benzaldehyde, 2-hydroxy-3-methoxy,orthovanilline,2-hydroxy-m-anisaldehyde,6-formyl-2-methoxyphenol,3-methoxy-2-hydroxybenzaldehyde PubChem CID: 8991 ChEBI: CHEBI:78339 IUPAC Name: 2-hydroxy-3-methoxybenzaldehyde SMILES: COC1=CC=CC(C=O)=C1O
| PubChem CID | 8991 |
|---|---|
| CAS | 148-53-8 |
| Molecular Weight (g/mol) | 152.15 |
| ChEBI | CHEBI:78339 |
| MDL Number | MFCD00003322 |
| SMILES | COC1=CC=CC(C=O)=C1O |
| Synonym | 3-methoxysalicylaldehyde,o-vanillin,6-formylguaiacol,2-vanillin,o-vanilline,benzaldehyde, 2-hydroxy-3-methoxy,orthovanilline,2-hydroxy-m-anisaldehyde,6-formyl-2-methoxyphenol,3-methoxy-2-hydroxybenzaldehyde |
| IUPAC Name | 2-hydroxy-3-methoxybenzaldehyde |
| InChI Key | JJVNINGBHGBWJH-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
Diethylene glycol diethyl ether, 99%
CAS: 112-36-7 Molecular Formula: C8H18O3 Molecular Weight (g/mol): 162.229 MDL Number: MFCD00009254 InChI Key: RRQYJINTUHWNHW-UHFFFAOYSA-N Synonym: diethylene glycol diethyl ether,2-ethoxyethyl ether,diethyl carbitol,ethyl diglyme,1-ethoxy-2-2-ethoxyethoxy ethane,bis 2-ethoxyethyl ether,diethyldiethylene glycol,3,6,9-trioxaundecane,degdee,ether, bis 2-ethoxyethyl PubChem CID: 8179 ChEBI: CHEBI:44664 IUPAC Name: 1-ethoxy-2-(2-ethoxyethoxy)ethane SMILES: CCOCCOCCOCC
| PubChem CID | 8179 |
|---|---|
| CAS | 112-36-7 |
| Molecular Weight (g/mol) | 162.229 |
| ChEBI | CHEBI:44664 |
| MDL Number | MFCD00009254 |
| SMILES | CCOCCOCCOCC |
| Synonym | diethylene glycol diethyl ether,2-ethoxyethyl ether,diethyl carbitol,ethyl diglyme,1-ethoxy-2-2-ethoxyethoxy ethane,bis 2-ethoxyethyl ether,diethyldiethylene glycol,3,6,9-trioxaundecane,degdee,ether, bis 2-ethoxyethyl |
| IUPAC Name | 1-ethoxy-2-(2-ethoxyethoxy)ethane |
| InChI Key | RRQYJINTUHWNHW-UHFFFAOYSA-N |
| Molecular Formula | C8H18O3 |
Ethylene glycol ethyl methyl ether, 97%, stab. with 0.01% BHT, Thermo Scientific Chemicals
CAS: 5137-45-1 Molecular Formula: C5H12O2 MDL Number: MFCD00048580 Synonym: 2,5-dioxaheptane,ethane, 1-ethoxy-2-methoxy,ethyl 2-methoxyethyl ether
| CAS | 5137-45-1 |
|---|---|
| MDL Number | MFCD00048580 |
| Synonym | 2,5-dioxaheptane,ethane, 1-ethoxy-2-methoxy,ethyl 2-methoxyethyl ether |
| Molecular Formula | C5H12O2 |
n-Butyrophenone, 99%
CAS: 495-40-9 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.2 InChI Key: FFSAXUULYPJSKH-UHFFFAOYSA-N Synonym: butyrophenone,n-butyrophenone,1-butanone, 1-phenyl,phenyl propyl ketone,1-phenyl-1-butanone,propyl phenyl ketone,unii-186i11wb5b,1-phenyl-butan-1-one,propylphenylketone PubChem CID: 10315 IUPAC Name: 1-phenylbutan-1-one SMILES: CCCC(=O)C1=CC=CC=C1
| PubChem CID | 10315 |
|---|---|
| CAS | 495-40-9 |
| Molecular Weight (g/mol) | 148.2 |
| SMILES | CCCC(=O)C1=CC=CC=C1 |
| Synonym | butyrophenone,n-butyrophenone,1-butanone, 1-phenyl,phenyl propyl ketone,1-phenyl-1-butanone,propyl phenyl ketone,unii-186i11wb5b,1-phenyl-butan-1-one,propylphenylketone |
| IUPAC Name | 1-phenylbutan-1-one |
| InChI Key | FFSAXUULYPJSKH-UHFFFAOYSA-N |
| Molecular Formula | C10H12O |
2-Acetylbenzo[b]furan, 99%
CAS: 1646-26-0 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.17 MDL Number: MFCD00005849 InChI Key: YUTFQTAITWWGFH-UHFFFAOYSA-N Synonym: 2-acetylbenzofuran,1-benzofuran-2-yl ethanone,ethanone, 1-2-benzofuranyl,benzofuran-2-yl methyl ketone,2-acetylcoumarone,2-acetylcumarone,2-benzofuranyl methyl ketone,benzo b furan-2-yl methyl ketone,1-2-benzofuranyl ethanone,2-acetylbenzo b furan PubChem CID: 15435 SMILES: CC(=O)C1=CC2=CC=CC=C2O1
| PubChem CID | 15435 |
|---|---|
| CAS | 1646-26-0 |
| Molecular Weight (g/mol) | 160.17 |
| MDL Number | MFCD00005849 |
| SMILES | CC(=O)C1=CC2=CC=CC=C2O1 |
| Synonym | 2-acetylbenzofuran,1-benzofuran-2-yl ethanone,ethanone, 1-2-benzofuranyl,benzofuran-2-yl methyl ketone,2-acetylcoumarone,2-acetylcumarone,2-benzofuranyl methyl ketone,benzo b furan-2-yl methyl ketone,1-2-benzofuranyl ethanone,2-acetylbenzo b furan |
| InChI Key | YUTFQTAITWWGFH-UHFFFAOYSA-N |
| Molecular Formula | C10H8O2 |