Organooxygen compounds
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(R)-(-)-1,3-Butanediol 98.0+%, TCI America™
CAS: 6290-03-5 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.12 MDL Number: MFCD00064277 InChI Key: PUPZLCDOIYMWBV-UHFFFAOYNA-N Synonym: r---1,3-butanediol,r-butane-1,3-diol,3r-butane-1,3-diol,r-1,3-butanediol,1,3-butanediol, 3r,r---1,3-butylene glycol,r---butane-1,3-diol,1,3-butanediol, r PubChem CID: 637497 ChEBI: CHEBI:52687 IUPAC Name: (3R)-butane-1,3-diol SMILES: CC(CCO)O
| PubChem CID | 637497 |
|---|---|
| CAS | 6290-03-5 |
| Molecular Weight (g/mol) | 90.12 |
| ChEBI | CHEBI:52687 |
| MDL Number | MFCD00064277 |
| SMILES | CC(CCO)O |
| Synonym | r---1,3-butanediol,r-butane-1,3-diol,3r-butane-1,3-diol,r-1,3-butanediol,1,3-butanediol, 3r,r---1,3-butylene glycol,r---butane-1,3-diol,1,3-butanediol, r |
| IUPAC Name | (3R)-butane-1,3-diol |
| InChI Key | PUPZLCDOIYMWBV-UHFFFAOYNA-N |
| Molecular Formula | C4H10O2 |
4'-Methoxyacetophenone 99.0+%, TCI America™
CAS: 100-06-1 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00008745 InChI Key: NTPLXRHDUXRPNE-UHFFFAOYSA-N Synonym: 4'-methoxyacetophenone,4-acetylanisole,4-methoxyacetophenone,1-4-methoxyphenyl ethanone,p-methoxyacetophenone,acetanisole,novatone,linarodin,vananote,ethanone, 1-4-methoxyphenyl PubChem CID: 7476 ChEBI: CHEBI:86567 IUPAC Name: 1-(4-methoxyphenyl)ethan-1-one SMILES: COC1=CC=C(C=C1)C(C)=O
| PubChem CID | 7476 |
|---|---|
| CAS | 100-06-1 |
| Molecular Weight (g/mol) | 150.18 |
| ChEBI | CHEBI:86567 |
| MDL Number | MFCD00008745 |
| SMILES | COC1=CC=C(C=C1)C(C)=O |
| Synonym | 4'-methoxyacetophenone,4-acetylanisole,4-methoxyacetophenone,1-4-methoxyphenyl ethanone,p-methoxyacetophenone,acetanisole,novatone,linarodin,vananote,ethanone, 1-4-methoxyphenyl |
| IUPAC Name | 1-(4-methoxyphenyl)ethan-1-one |
| InChI Key | NTPLXRHDUXRPNE-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
6-Methoxyquinoline 97.0+%, TCI America™
CAS: 5263-87-6 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.188 MDL Number: MFCD00006800 InChI Key: HFDLDPJYCIEXJP-UHFFFAOYSA-N Synonym: quinoline, 6-methoxy,6-methoxy-quinoline,methyl 6-quinolyl ether,p-quinanisole,unii-5s1u3125ad,chembl15200,6-methoxy quinoline,pubchem5917,6-methoxyquinoline,acmc-209l0q PubChem CID: 14860 ChEBI: CHEBI:72822 IUPAC Name: 6-methoxyquinoline SMILES: COC1=CC2=C(C=C1)N=CC=C2
| PubChem CID | 14860 |
|---|---|
| CAS | 5263-87-6 |
| Molecular Weight (g/mol) | 159.188 |
| ChEBI | CHEBI:72822 |
| MDL Number | MFCD00006800 |
| SMILES | COC1=CC2=C(C=C1)N=CC=C2 |
| Synonym | quinoline, 6-methoxy,6-methoxy-quinoline,methyl 6-quinolyl ether,p-quinanisole,unii-5s1u3125ad,chembl15200,6-methoxy quinoline,pubchem5917,6-methoxyquinoline,acmc-209l0q |
| IUPAC Name | 6-methoxyquinoline |
| InChI Key | HFDLDPJYCIEXJP-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO |
2,4,6-Trihydroxybenzaldehyde 98.0+%, TCI America™
CAS: 487-70-7 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.12 MDL Number: MFCD00003329 InChI Key: BTQAJGSMXCDDAJ-UHFFFAOYSA-N Synonym: phloroglucinaldehyde,benzaldehyde, 2,4,6-trihydroxy,formylphloroglucinal,phloroglucinolcarboxaldehyde,formylphloroglucinol,phloroglucinol aldehyde,2,4,6-trihydroxy-benzaldehyde,2,4,6-trihydroxybenzaldehyd,pubchem21790,acmc-1ao01 PubChem CID: 68099 IUPAC Name: 2,4,6-trihydroxybenzaldehyde SMILES: OC1=CC(O)=C(C=O)C(O)=C1
| PubChem CID | 68099 |
|---|---|
| CAS | 487-70-7 |
| Molecular Weight (g/mol) | 154.12 |
| MDL Number | MFCD00003329 |
| SMILES | OC1=CC(O)=C(C=O)C(O)=C1 |
| Synonym | phloroglucinaldehyde,benzaldehyde, 2,4,6-trihydroxy,formylphloroglucinal,phloroglucinolcarboxaldehyde,formylphloroglucinol,phloroglucinol aldehyde,2,4,6-trihydroxy-benzaldehyde,2,4,6-trihydroxybenzaldehyd,pubchem21790,acmc-1ao01 |
| IUPAC Name | 2,4,6-trihydroxybenzaldehyde |
| InChI Key | BTQAJGSMXCDDAJ-UHFFFAOYSA-N |
| Molecular Formula | C7H6O4 |
4H-Cyclopenta[1,2-b:5,4-b']dithiophen-4-one 98.0+%, TCI America™
CAS: 25796-77-4 Molecular Formula: C9H4OS2 Molecular Weight (g/mol): 192.25 MDL Number: MFCD16619150 InChI Key: HFIUHKXJUKKOIZ-UHFFFAOYSA-N PubChem CID: 10976338 IUPAC Name: 3,11-dithiatricyclo[6.3.0.0²,⁶]undeca-1(8),2(6),4,9-tetraen-7-one SMILES: O=C1C2=C(SC=C2)C2=C1C=CS2
| PubChem CID | 10976338 |
|---|---|
| CAS | 25796-77-4 |
| Molecular Weight (g/mol) | 192.25 |
| MDL Number | MFCD16619150 |
| SMILES | O=C1C2=C(SC=C2)C2=C1C=CS2 |
| IUPAC Name | 3,11-dithiatricyclo[6.3.0.0²,⁶]undeca-1(8),2(6),4,9-tetraen-7-one |
| InChI Key | HFIUHKXJUKKOIZ-UHFFFAOYSA-N |
| Molecular Formula | C9H4OS2 |
1,4-Butanediol Bis(3-aminopropyl) Ether 98.0+%, TCI America™
CAS: 7300-34-7 Molecular Formula: C10H24N2O2 Molecular Weight (g/mol): 204.31 MDL Number: MFCD00009802 InChI Key: YOOSAIJKYCBPFW-UHFFFAOYSA-N Synonym: 1,4-bis 3-aminopropoxy butane,4,9-dioxa-1,12-dodecanediamine,4,9-dioxadodecane-1,12-diamine,1,12-diamino-4,9-dioxadodecane,1,4-butanediol bis 3-aminopropyl ether,3,3'-tetramethylenedioxy bis propylamine,1,4-bis gamma-aminopropoxy butane,alpha,omega-diamino-4,9-dioxadodecane,3,3'-butane-1,4-diylbis oxy bis propan-1-amine,1,4-butanediol bis gamma-aminopropyl ether PubChem CID: 81729 IUPAC Name: 3-[4-(3-aminopropoxy)butoxy]propan-1-amine SMILES: NCCCOCCCCOCCCN
| PubChem CID | 81729 |
|---|---|
| CAS | 7300-34-7 |
| Molecular Weight (g/mol) | 204.31 |
| MDL Number | MFCD00009802 |
| SMILES | NCCCOCCCCOCCCN |
| Synonym | 1,4-bis 3-aminopropoxy butane,4,9-dioxa-1,12-dodecanediamine,4,9-dioxadodecane-1,12-diamine,1,12-diamino-4,9-dioxadodecane,1,4-butanediol bis 3-aminopropyl ether,3,3'-tetramethylenedioxy bis propylamine,1,4-bis gamma-aminopropoxy butane,alpha,omega-diamino-4,9-dioxadodecane,3,3'-butane-1,4-diylbis oxy bis propan-1-amine,1,4-butanediol bis gamma-aminopropyl ether |
| IUPAC Name | 3-[4-(3-aminopropoxy)butoxy]propan-1-amine |
| InChI Key | YOOSAIJKYCBPFW-UHFFFAOYSA-N |
| Molecular Formula | C10H24N2O2 |
3-Acetyl-2,5-dichlorothiophene 98.0+%, TCI America™
CAS: 36157-40-1 Molecular Formula: C6H4Cl2OS Molecular Weight (g/mol): 195.057 MDL Number: MFCD00014522 InChI Key: GYFDNIRENHZKGR-UHFFFAOYSA-N Synonym: 3-acetyl-2,5-dichlorothiophene,1-2,5-dichlorothiophen-3-yl ethanone,1-2,5-dichloro-3-thienyl ethan-1-one,1-2,5-dichlorothiophen-3-yl ethan-1-one,1-2,5-dichloro-3-thienyl ethanone,2,5-dichloro-3-thienyl methyl ketone,ethanone, 1-2,5-dichloro-3-thienyl,1-2,5-dichloro-thiophen-3-yl-ethanone,1-2,5-dichlorothien-3-yl ethan-1-one,zlchem 481 PubChem CID: 118920 IUPAC Name: 1-(2,5-dichlorothiophen-3-yl)ethanone SMILES: CC(=O)C1=C(SC(=C1)Cl)Cl
| PubChem CID | 118920 |
|---|---|
| CAS | 36157-40-1 |
| Molecular Weight (g/mol) | 195.057 |
| MDL Number | MFCD00014522 |
| SMILES | CC(=O)C1=C(SC(=C1)Cl)Cl |
| Synonym | 3-acetyl-2,5-dichlorothiophene,1-2,5-dichlorothiophen-3-yl ethanone,1-2,5-dichloro-3-thienyl ethan-1-one,1-2,5-dichlorothiophen-3-yl ethan-1-one,1-2,5-dichloro-3-thienyl ethanone,2,5-dichloro-3-thienyl methyl ketone,ethanone, 1-2,5-dichloro-3-thienyl,1-2,5-dichloro-thiophen-3-yl-ethanone,1-2,5-dichlorothien-3-yl ethan-1-one,zlchem 481 |
| IUPAC Name | 1-(2,5-dichlorothiophen-3-yl)ethanone |
| InChI Key | GYFDNIRENHZKGR-UHFFFAOYSA-N |
| Molecular Formula | C6H4Cl2OS |
tert-Butyl 12-Hydroxy-4,7,10-trioxadodecanoate 97.0+%, TCI America™
CAS: 186020-66-6 Molecular Formula: C13H26O6 Molecular Weight (g/mol): 278.345 MDL Number: MFCD03791106 InChI Key: KSXVEOLRERRELV-UHFFFAOYSA-N Synonym: 12-Hydroxy-4,7,10-trioxadodecanoic Acid tert-Butyl Ester, tert-Butyl 3-[2-(2-(2-Hydroxyethoxy)ethoxy)ethoxy]propionate, 3-[2-[2-(2-Hydroxyethoxy)ethoxy]ethoxy]propionic Acid tert-Butyl Ester PubChem CID: 3625858 IUPAC Name: tert-butyl 3-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]propanoate SMILES: CC(C)(C)OC(=O)CCOCCOCCOCCO
| PubChem CID | 3625858 |
|---|---|
| CAS | 186020-66-6 |
| Molecular Weight (g/mol) | 278.345 |
| MDL Number | MFCD03791106 |
| SMILES | CC(C)(C)OC(=O)CCOCCOCCOCCO |
| Synonym | 12-Hydroxy-4,7,10-trioxadodecanoic Acid tert-Butyl Ester, tert-Butyl 3-[2-(2-(2-Hydroxyethoxy)ethoxy)ethoxy]propionate, 3-[2-[2-(2-Hydroxyethoxy)ethoxy]ethoxy]propionic Acid tert-Butyl Ester |
| IUPAC Name | tert-butyl 3-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]propanoate |
| InChI Key | KSXVEOLRERRELV-UHFFFAOYSA-N |
| Molecular Formula | C13H26O6 |
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 |
2-Acetylfuran 98.0+%, TCI America™
CAS: 1192-62-7 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00003242 InChI Key: IEMMBWWQXVXBEU-UHFFFAOYSA-N Synonym: 2-acetylfuran,acetylfuran,1-furan-2-yl ethanone,2-furyl methyl ketone,methyl 2-furyl ketone,1-2-furyl ethanone,2-furylethanone,2-acetyl furan,ketone, 2-furyl methyl,ethanone, 1-2-furanyl PubChem CID: 14505 ChEBI: CHEBI:59983 IUPAC Name: 1-(furan-2-yl)ethanone SMILES: CC(=O)C1=CC=CO1
| PubChem CID | 14505 |
|---|---|
| CAS | 1192-62-7 |
| Molecular Weight (g/mol) | 110.112 |
| ChEBI | CHEBI:59983 |
| MDL Number | MFCD00003242 |
| SMILES | CC(=O)C1=CC=CO1 |
| Synonym | 2-acetylfuran,acetylfuran,1-furan-2-yl ethanone,2-furyl methyl ketone,methyl 2-furyl ketone,1-2-furyl ethanone,2-furylethanone,2-acetyl furan,ketone, 2-furyl methyl,ethanone, 1-2-furanyl |
| IUPAC Name | 1-(furan-2-yl)ethanone |
| InChI Key | IEMMBWWQXVXBEU-UHFFFAOYSA-N |
| Molecular Formula | C6H6O2 |
2-Acetyl-5-bromothiophene 98.0+%, TCI America™
CAS: 5370-25-2 Molecular Formula: C6H5BrOS Molecular Weight (g/mol): 205.069 MDL Number: MFCD00014528 InChI Key: IGBZCOWXSCWSHO-UHFFFAOYSA-N Synonym: 2-acetyl-5-bromothiophene,1-5-bromothiophen-2-yl ethanone,ethanone, 1-5-bromo-2-thienyl,1-5-bromo-2-thienyl ethan-1-one,1-5-bromothiophen-2-yl ethan-1-one,5-bromo-2-thienyl methyl ketone,2-acetyl-5-bromo thiophene,ketone, 5-bromo-2-thienyl methyl,2-acetyl-5-bromo-thiophene,1-5-bromo-2-thienyl ethanone PubChem CID: 79335 IUPAC Name: 1-(5-bromothiophen-2-yl)ethanone SMILES: CC(=O)C1=CC=C(S1)Br
| PubChem CID | 79335 |
|---|---|
| CAS | 5370-25-2 |
| Molecular Weight (g/mol) | 205.069 |
| MDL Number | MFCD00014528 |
| SMILES | CC(=O)C1=CC=C(S1)Br |
| Synonym | 2-acetyl-5-bromothiophene,1-5-bromothiophen-2-yl ethanone,ethanone, 1-5-bromo-2-thienyl,1-5-bromo-2-thienyl ethan-1-one,1-5-bromothiophen-2-yl ethan-1-one,5-bromo-2-thienyl methyl ketone,2-acetyl-5-bromo thiophene,ketone, 5-bromo-2-thienyl methyl,2-acetyl-5-bromo-thiophene,1-5-bromo-2-thienyl ethanone |
| IUPAC Name | 1-(5-bromothiophen-2-yl)ethanone |
| InChI Key | IGBZCOWXSCWSHO-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrOS |
2-Acetyl-5-methylthiophene 96.0+%, TCI America™
CAS: 13679-74-8 Molecular Formula: C7H8OS Molecular Weight (g/mol): 140.20 MDL Number: MFCD00014529 InChI Key: YOSDTJYMDAEEAZ-UHFFFAOYSA-N Synonym: 2-acetyl-5-methylthiophene,1-5-methylthiophen-2-yl ethanone,ketone, methyl 5-methyl-2-thienyl,1-5-methyl-2-thienyl ethan-1-one,2-methyl-5-acetylthiophene,ethanone, 1-5-methyl-2-thienyl,methylthienylcetone,1-5-methyl-2-thienyl ethanone,5-methyl-2-acetylthiophene,methyl 5-methyl-2-thienyl ketone PubChem CID: 83655 IUPAC Name: 1-(5-methylthiophen-2-yl)ethan-1-one SMILES: CC(=O)C1=CC=C(C)S1
| PubChem CID | 83655 |
|---|---|
| CAS | 13679-74-8 |
| Molecular Weight (g/mol) | 140.20 |
| MDL Number | MFCD00014529 |
| SMILES | CC(=O)C1=CC=C(C)S1 |
| Synonym | 2-acetyl-5-methylthiophene,1-5-methylthiophen-2-yl ethanone,ketone, methyl 5-methyl-2-thienyl,1-5-methyl-2-thienyl ethan-1-one,2-methyl-5-acetylthiophene,ethanone, 1-5-methyl-2-thienyl,methylthienylcetone,1-5-methyl-2-thienyl ethanone,5-methyl-2-acetylthiophene,methyl 5-methyl-2-thienyl ketone |
| IUPAC Name | 1-(5-methylthiophen-2-yl)ethan-1-one |
| InChI Key | YOSDTJYMDAEEAZ-UHFFFAOYSA-N |
| Molecular Formula | C7H8OS |
2'-Hydroxy-4',6'-dimethoxy-2-(4-methoxyphenyl)acetophenone 98.0+%, TCI America™
CAS: 39604-68-7 Molecular Formula: C17H18O5 Molecular Weight (g/mol): 302.33 MDL Number: MFCD03934798 InChI Key: ROJOJPXRGHLGTC-UHFFFAOYSA-N Synonym: 2-Hydroxy-4,6-dimethoxyphenyl 4-Methoxybenzyl Ketone PubChem CID: 689039 IUPAC Name: 1-(2-hydroxy-4,6-dimethoxyphenyl)-2-(4-methoxyphenyl)ethan-1-one SMILES: COC1=CC=C(CC(=O)C2=C(O)C=C(OC)C=C2OC)C=C1
| PubChem CID | 689039 |
|---|---|
| CAS | 39604-68-7 |
| Molecular Weight (g/mol) | 302.33 |
| MDL Number | MFCD03934798 |
| SMILES | COC1=CC=C(CC(=O)C2=C(O)C=C(OC)C=C2OC)C=C1 |
| Synonym | 2-Hydroxy-4,6-dimethoxyphenyl 4-Methoxybenzyl Ketone |
| IUPAC Name | 1-(2-hydroxy-4,6-dimethoxyphenyl)-2-(4-methoxyphenyl)ethan-1-one |
| InChI Key | ROJOJPXRGHLGTC-UHFFFAOYSA-N |
| Molecular Formula | C17H18O5 |
1-Phenylethane-1,2-diol 98.0+%, TCI America™
CAS: 93-56-1 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00003546 InChI Key: PWMWNFMRSKOCEY-UHFFFAOYSA-N Synonym: 1-phenyl-1,2-ethanediol,styrene glycol,phenylethylene glycol,phenylethanediol,phenyl glycol,1,2-ethanediol, 1-phenyl,phenyl-1,2-ethanediol,styrolyl alcohol,fenylglycol,1-phenylethylene glycol PubChem CID: 7149 IUPAC Name: 1-phenylethane-1,2-diol SMILES: C1=CC=C(C=C1)C(CO)O
| PubChem CID | 7149 |
|---|---|
| CAS | 93-56-1 |
| Molecular Weight (g/mol) | 138.166 |
| MDL Number | MFCD00003546 |
| SMILES | C1=CC=C(C=C1)C(CO)O |
| Synonym | 1-phenyl-1,2-ethanediol,styrene glycol,phenylethylene glycol,phenylethanediol,phenyl glycol,1,2-ethanediol, 1-phenyl,phenyl-1,2-ethanediol,styrolyl alcohol,fenylglycol,1-phenylethylene glycol |
| IUPAC Name | 1-phenylethane-1,2-diol |
| InChI Key | PWMWNFMRSKOCEY-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
Bis(2,4-pentanedionato)titanium(IV) Oxide, TCI America™
CAS: 14024-64-7 Molecular Formula: C10H16O5Ti Molecular Weight (g/mol): 264.1 MDL Number: MFCD00013505 InChI Key: ADVORQMAWLEPOI-UHFFFAOYSA-N Synonym: bis acetylacetonato titanium iv oxide,bis 4-hydroxypent-3-en-2-one ; titanium ii oxide PubChem CID: 74765597 IUPAC Name: 4-hydroxypent-3-en-2-one;oxotitanium SMILES: CC(=CC(=O)C)O.CC(=CC(=O)C)O.O=[Ti]
| PubChem CID | 74765597 |
|---|---|
| CAS | 14024-64-7 |
| Molecular Weight (g/mol) | 264.1 |
| MDL Number | MFCD00013505 |
| SMILES | CC(=CC(=O)C)O.CC(=CC(=O)C)O.O=[Ti] |
| Synonym | bis acetylacetonato titanium iv oxide,bis 4-hydroxypent-3-en-2-one ; titanium ii oxide |
| IUPAC Name | 4-hydroxypent-3-en-2-one;oxotitanium |
| InChI Key | ADVORQMAWLEPOI-UHFFFAOYSA-N |
| Molecular Formula | C10H16O5Ti |