Organooxygen compounds
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Dicyclohexano-18-crown 6-Ether 98.0+%, TCI America™
CAS: 16069-36-6 Molecular Formula: C20H36O6 Molecular Weight (g/mol): 372.502 MDL Number: MFCD00005099 InChI Key: BBGKDYHZQOSNMU-UHFFFAOYSA-N Synonym: dicyclohexano-18-crown-6,dicyclohexyl-18-crown-6,cis-dicyclohexano-18-crown-6,dicyclohexo-18-crown-6,perhydrodibenzo-18-crown-6,dch-18-crown-6,icosahydrodibenzo b,k 1,4,7,10,13,16 hexaoxacyclooctadecine,dicyclohexyl-18-crown-6 ether,dicyclohexyl 18-crown-6,ccris 3612 PubChem CID: 85955 SMILES: C1CCC2C(C1)OCCOCCOC3CCCCC3OCCOCCO2
| PubChem CID | 85955 |
|---|---|
| CAS | 16069-36-6 |
| Molecular Weight (g/mol) | 372.502 |
| MDL Number | MFCD00005099 |
| SMILES | C1CCC2C(C1)OCCOCCOC3CCCCC3OCCOCCO2 |
| Synonym | dicyclohexano-18-crown-6,dicyclohexyl-18-crown-6,cis-dicyclohexano-18-crown-6,dicyclohexo-18-crown-6,perhydrodibenzo-18-crown-6,dch-18-crown-6,icosahydrodibenzo b,k 1,4,7,10,13,16 hexaoxacyclooctadecine,dicyclohexyl-18-crown-6 ether,dicyclohexyl 18-crown-6,ccris 3612 |
| InChI Key | BBGKDYHZQOSNMU-UHFFFAOYSA-N |
| Molecular Formula | C20H36O6 |
2-Methylbutyraldehyde 95.0+%, TCI America™
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 |
Isobutyraldehyde 98.0+%, TCI America™
CAS: 78-84-2 Molecular Formula: C4H8O Molecular Weight (g/mol): 72.11 MDL Number: MFCD00006980 InChI Key: AMIMRNSIRUDHCM-UHFFFAOYSA-N Synonym: isobutyraldehyde,isobutanal,isobutylaldehyde,propanal, 2-methyl,2-methylpropionaldehyde,isobutyric aldehyde,valine aldehyde,isopropylaldehyde,2-methyl-1-propanal,isobutaldehyde PubChem CID: 6561 ChEBI: CHEBI:48943 IUPAC Name: 2-methylpropanal SMILES: CC(C)C=O
| PubChem CID | 6561 |
|---|---|
| CAS | 78-84-2 |
| Molecular Weight (g/mol) | 72.11 |
| ChEBI | CHEBI:48943 |
| MDL Number | MFCD00006980 |
| SMILES | CC(C)C=O |
| Synonym | isobutyraldehyde,isobutanal,isobutylaldehyde,propanal, 2-methyl,2-methylpropionaldehyde,isobutyric aldehyde,valine aldehyde,isopropylaldehyde,2-methyl-1-propanal,isobutaldehyde |
| IUPAC Name | 2-methylpropanal |
| InChI Key | AMIMRNSIRUDHCM-UHFFFAOYSA-N |
| Molecular Formula | C4H8O |
2'-Chloroacetophenone 97.0+%, TCI America™
CAS: 2142-68-9 Molecular Formula: C8H7ClO Molecular Weight (g/mol): 154.593 MDL Number: MFCD00000560 InChI Key: ZDOYHCIRUPHUHN-UHFFFAOYSA-N Synonym: 2'-chloroacetophenone,1-2-chlorophenyl ethanone,o-chloroacetophenone,1-2-chlorophenyl ethan-1-one,ethanone, 1-2-chlorophenyl,acetophenone, 2'-chloro,o-chloroacetophonone,1-2-chloro-phenyl-ethanone,ethanone, 1-chlorophenyl,1-acetyl-2-chlorobenzene PubChem CID: 72864 IUPAC Name: 1-(2-chlorophenyl)ethanone SMILES: CC(=O)C1=CC=CC=C1Cl
| PubChem CID | 72864 |
|---|---|
| CAS | 2142-68-9 |
| Molecular Weight (g/mol) | 154.593 |
| MDL Number | MFCD00000560 |
| SMILES | CC(=O)C1=CC=CC=C1Cl |
| Synonym | 2'-chloroacetophenone,1-2-chlorophenyl ethanone,o-chloroacetophenone,1-2-chlorophenyl ethan-1-one,ethanone, 1-2-chlorophenyl,acetophenone, 2'-chloro,o-chloroacetophonone,1-2-chloro-phenyl-ethanone,ethanone, 1-chlorophenyl,1-acetyl-2-chlorobenzene |
| IUPAC Name | 1-(2-chlorophenyl)ethanone |
| InChI Key | ZDOYHCIRUPHUHN-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO |
Benzal Diacetate 95.0+%, TCI America™
CAS: 581-55-5 Molecular Formula: C11H12O4 Molecular Weight (g/mol): 208.213 MDL Number: MFCD00059206 InChI Key: XRYSDRCNTMEYFH-UHFFFAOYSA-N Synonym: benzal diacetate,benzylidene diacetate,phenylmethylene diacetate,benzaldiacetate,methanediol, phenyl-, diacetate,benzaldiacetat,m-diacetoxymethylbenzene,diacetic acid benzylidene,phenylmethanediyl diacetate,phenylmethanediol diacetate PubChem CID: 68489 IUPAC Name: [acetyloxy(phenyl)methyl] acetate SMILES: CC(=O)OC(C1=CC=CC=C1)OC(=O)C
| PubChem CID | 68489 |
|---|---|
| CAS | 581-55-5 |
| Molecular Weight (g/mol) | 208.213 |
| MDL Number | MFCD00059206 |
| SMILES | CC(=O)OC(C1=CC=CC=C1)OC(=O)C |
| Synonym | benzal diacetate,benzylidene diacetate,phenylmethylene diacetate,benzaldiacetate,methanediol, phenyl-, diacetate,benzaldiacetat,m-diacetoxymethylbenzene,diacetic acid benzylidene,phenylmethanediyl diacetate,phenylmethanediol diacetate |
| IUPAC Name | [acetyloxy(phenyl)methyl] acetate |
| InChI Key | XRYSDRCNTMEYFH-UHFFFAOYSA-N |
| Molecular Formula | C11H12O4 |
Ketorolac Tromethamine 98.0+%, TCI America™
CAS: 74103-07-4 Molecular Formula: C19H24N2O6 Molecular Weight (g/mol): 376.41 MDL Number: MFCD00887595 InChI Key: BWHLPLXXIDYSNW-UHFFFAOYNA-N Synonym: Ketorolac Tris Salt, (+/-)-5-Benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic Acid Tris Salt PubChem CID: 84003 ChEBI: CHEBI:6130 IUPAC Name: 2-amino-2-(hydroxymethyl)propane-1,3-diol; 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid SMILES: NC(CO)(CO)CO.OC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=CC=C1
| PubChem CID | 84003 |
|---|---|
| CAS | 74103-07-4 |
| Molecular Weight (g/mol) | 376.41 |
| ChEBI | CHEBI:6130 |
| MDL Number | MFCD00887595 |
| SMILES | NC(CO)(CO)CO.OC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=CC=C1 |
| Synonym | Ketorolac Tris Salt, (+/-)-5-Benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic Acid Tris Salt |
| IUPAC Name | 2-amino-2-(hydroxymethyl)propane-1,3-diol; 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid |
| InChI Key | BWHLPLXXIDYSNW-UHFFFAOYNA-N |
| Molecular Formula | C19H24N2O6 |
2-Isobutoxynaphthalene 98.0+%, TCI America™
CAS: 2173-57-1 Molecular Formula: C14H16O Molecular Weight (g/mol): 200.28 MDL Number: MFCD00046467 InChI Key: XOHIHZHSDMWWMS-UHFFFAOYSA-N Synonym: Isobutyl 2-Naphthyl Ether PubChem CID: 16582 IUPAC Name: 2-(2-methylpropoxy)naphthalene SMILES: CC(C)COC1=CC=C2C=CC=CC2=C1
| PubChem CID | 16582 |
|---|---|
| CAS | 2173-57-1 |
| Molecular Weight (g/mol) | 200.28 |
| MDL Number | MFCD00046467 |
| SMILES | CC(C)COC1=CC=C2C=CC=CC2=C1 |
| Synonym | Isobutyl 2-Naphthyl Ether |
| IUPAC Name | 2-(2-methylpropoxy)naphthalene |
| InChI Key | XOHIHZHSDMWWMS-UHFFFAOYSA-N |
| Molecular Formula | C14H16O |
alpha-Thioglycerol 95.0+%, TCI America™
CAS: 96-27-5 Molecular Formula: C3H8O2S Molecular Weight (g/mol): 108.16 MDL Number: MFCD00004879 InChI Key: PJUIMOJAAPLTRJ-UHFFFAOYNA-N Synonym: 3-mercapto-1,2-propanediol,monothioglycerol,1-thioglycerol,thioglycerol,thioglycerine,thioglycerin,thiovanol,3-mercaptopropane-1,2-diol,alpha-thioglycerol,glycerol-1-thiol PubChem CID: 7291 ChEBI: CHEBI:74537 IUPAC Name: 3-sulfanylpropane-1,2-diol SMILES: OCC(O)CS
| PubChem CID | 7291 |
|---|---|
| CAS | 96-27-5 |
| Molecular Weight (g/mol) | 108.16 |
| ChEBI | CHEBI:74537 |
| MDL Number | MFCD00004879 |
| SMILES | OCC(O)CS |
| Synonym | 3-mercapto-1,2-propanediol,monothioglycerol,1-thioglycerol,thioglycerol,thioglycerine,thioglycerin,thiovanol,3-mercaptopropane-1,2-diol,alpha-thioglycerol,glycerol-1-thiol |
| IUPAC Name | 3-sulfanylpropane-1,2-diol |
| InChI Key | PJUIMOJAAPLTRJ-UHFFFAOYNA-N |
| Molecular Formula | C3H8O2S |
LabChem, Inc. Ascorbic Acid, Reagent Grade, LabChem™
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: (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-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 | (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one |
| InChI Key | CIWBSHSKHKDKBQ-DOMZIZNONA-N |
| Molecular Formula | C6H8O6 |
3-Methoxybutyl Acetate 99.0+%, TCI America™
CAS: 4435-53-4 Molecular Formula: C7H14O3 Molecular Weight (g/mol): 146.19 MDL Number: MFCD00043928 InChI Key: QMYGFTJCQFEDST-UHFFFAOYNA-N Synonym: Acetic Acid 3-Methoxybutyl Ester PubChem CID: 20498 IUPAC Name: 3-methoxybutyl acetate SMILES: COC(C)CCOC(C)=O
| PubChem CID | 20498 |
|---|---|
| CAS | 4435-53-4 |
| Molecular Weight (g/mol) | 146.19 |
| MDL Number | MFCD00043928 |
| SMILES | COC(C)CCOC(C)=O |
| Synonym | Acetic Acid 3-Methoxybutyl Ester |
| IUPAC Name | 3-methoxybutyl acetate |
| InChI Key | QMYGFTJCQFEDST-UHFFFAOYNA-N |
| Molecular Formula | C7H14O3 |
Nonanal 95.0+%, TCI America™
CAS: 124-19-6 Molecular Formula: C9H18O Molecular Weight (g/mol): 142.242 MDL Number: MFCD00007030 InChI Key: GYHFUZHODSMOHU-UHFFFAOYSA-N Synonym: pelargonaldehyde,1-nonanal,nonanaldehyde,nonyl aldehyde,n-nonaldehyde,nonylic aldehyde,nonylaldehyde,nonaldehyde,n-nonanal,1-nonaldehyde PubChem CID: 31289 ChEBI: CHEBI:84268 IUPAC Name: nonanal SMILES: CCCCCCCCC=O
| PubChem CID | 31289 |
|---|---|
| CAS | 124-19-6 |
| Molecular Weight (g/mol) | 142.242 |
| ChEBI | CHEBI:84268 |
| MDL Number | MFCD00007030 |
| SMILES | CCCCCCCCC=O |
| Synonym | pelargonaldehyde,1-nonanal,nonanaldehyde,nonyl aldehyde,n-nonaldehyde,nonylic aldehyde,nonylaldehyde,nonaldehyde,n-nonanal,1-nonaldehyde |
| IUPAC Name | nonanal |
| InChI Key | GYHFUZHODSMOHU-UHFFFAOYSA-N |
| Molecular Formula | C9H18O |
(R)-(-)-1,2-Propanediol 97.0+%, TCI America™
CAS: 4254-14-2 Molecular Formula: C3H8O2 Molecular Weight (g/mol): 76.095 MDL Number: MFCD00066248 InChI Key: DNIAPMSPPWPWGF-GSVOUGTGSA-N Synonym: r---1,2-propanediol,r-propane-1,2-diol,2r-propane-1,2-diol,r-1,2-propanediol,r-propylene glycol,2r-1,2-propanediol,r---1,2-dihydroxypropane,unii-602hn5l69h PubChem CID: 259994 ChEBI: CHEBI:28972 IUPAC Name: (2R)-propane-1,2-diol SMILES: CC(CO)O
| PubChem CID | 259994 |
|---|---|
| CAS | 4254-14-2 |
| Molecular Weight (g/mol) | 76.095 |
| ChEBI | CHEBI:28972 |
| MDL Number | MFCD00066248 |
| SMILES | CC(CO)O |
| Synonym | r---1,2-propanediol,r-propane-1,2-diol,2r-propane-1,2-diol,r-1,2-propanediol,r-propylene glycol,2r-1,2-propanediol,r---1,2-dihydroxypropane,unii-602hn5l69h |
| IUPAC Name | (2R)-propane-1,2-diol |
| InChI Key | DNIAPMSPPWPWGF-GSVOUGTGSA-N |
| Molecular Formula | C3H8O2 |
3-tert-Butylsalicylaldehyde 95.0+%, TCI America™
CAS: 24623-65-2 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.23 MDL Number: MFCD00778877 InChI Key: ROILLNJICXGZQQ-UHFFFAOYSA-N Synonym: 3-tert-butyl-2-hydroxybenzaldehyde,3-tert-butylsalicylaldehyde,3-t-butylsalicylaldehyde,benzaldehyde, 3-1,1-dimethylethyl-2-hydroxy,3-tert-butyl-2-hydroxy-benzaldehyde,3-tert-butyl salicylaldehyde,acmc-1ceew,3-tertbutylsalicylaldehyde,2-hydroxy-3-tert.butylbenzaldehyde,3-tert-butyl-2-oxidanyl-benzaldehyde PubChem CID: 3678675 IUPAC Name: 3-tert-butyl-2-hydroxybenzaldehyde SMILES: CC(C)(C)C1=CC=CC(C=O)=C1O
| PubChem CID | 3678675 |
|---|---|
| CAS | 24623-65-2 |
| Molecular Weight (g/mol) | 178.23 |
| MDL Number | MFCD00778877 |
| SMILES | CC(C)(C)C1=CC=CC(C=O)=C1O |
| Synonym | 3-tert-butyl-2-hydroxybenzaldehyde,3-tert-butylsalicylaldehyde,3-t-butylsalicylaldehyde,benzaldehyde, 3-1,1-dimethylethyl-2-hydroxy,3-tert-butyl-2-hydroxy-benzaldehyde,3-tert-butyl salicylaldehyde,acmc-1ceew,3-tertbutylsalicylaldehyde,2-hydroxy-3-tert.butylbenzaldehyde,3-tert-butyl-2-oxidanyl-benzaldehyde |
| IUPAC Name | 3-tert-butyl-2-hydroxybenzaldehyde |
| InChI Key | ROILLNJICXGZQQ-UHFFFAOYSA-N |
| Molecular Formula | C11H14O2 |
5-Fluoro-1-indanone 96.0+%, TCI America™
CAS: 700-84-5 Molecular Formula: C9H7FO Molecular Weight (g/mol): 150.15 MDL Number: MFCD00041031 InChI Key: WVPPBVAMKNQXJA-UHFFFAOYSA-N Synonym: 5-fluoro-1-indanone,5-fluoro-2,3-dihydro-1h-inden-1-one,5-fluoroindan-1-one,1h-inden-1-one, 5-fluoro-2,3-dihydro,2,3-dihydro-5-fluoro-1h-inden-1-one,5-fluoroindanone,5-fluoro indanone,pubchem2388,5-flouro-1-indanone,pubchem13785 PubChem CID: 136537 IUPAC Name: 5-fluoro-2,3-dihydro-1H-inden-1-one SMILES: FC1=CC=C2C(=O)CCC2=C1
| PubChem CID | 136537 |
|---|---|
| CAS | 700-84-5 |
| Molecular Weight (g/mol) | 150.15 |
| MDL Number | MFCD00041031 |
| SMILES | FC1=CC=C2C(=O)CCC2=C1 |
| Synonym | 5-fluoro-1-indanone,5-fluoro-2,3-dihydro-1h-inden-1-one,5-fluoroindan-1-one,1h-inden-1-one, 5-fluoro-2,3-dihydro,2,3-dihydro-5-fluoro-1h-inden-1-one,5-fluoroindanone,5-fluoro indanone,pubchem2388,5-flouro-1-indanone,pubchem13785 |
| IUPAC Name | 5-fluoro-2,3-dihydro-1H-inden-1-one |
| InChI Key | WVPPBVAMKNQXJA-UHFFFAOYSA-N |
| Molecular Formula | C9H7FO |
6-Methoxy-1-indanone 98.0+%, TCI America™
CAS: 13623-25-1 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00021232 InChI Key: UJGDLLGKMWVCPT-UHFFFAOYSA-N Synonym: 6-methoxy-1-indanone,6-methoxy-1h-indanone,6-methoxy-indan-1-one,6-methoxy-2,3-dihydro-1h-inden-1-one,6-methoxyindan-1-one,2,3-dihydro-6-methoxyinden-1-one,1h-inden-1-one, 2,3-dihydro-6-methoxy,6-methoxyindanone,6-methoxy indanone,6-methoxy-1-indanon PubChem CID: 334036 IUPAC Name: 6-methoxy-2,3-dihydro-1H-inden-1-one SMILES: COC1=CC=C2CCC(=O)C2=C1
| PubChem CID | 334036 |
|---|---|
| CAS | 13623-25-1 |
| Molecular Weight (g/mol) | 162.19 |
| MDL Number | MFCD00021232 |
| SMILES | COC1=CC=C2CCC(=O)C2=C1 |
| Synonym | 6-methoxy-1-indanone,6-methoxy-1h-indanone,6-methoxy-indan-1-one,6-methoxy-2,3-dihydro-1h-inden-1-one,6-methoxyindan-1-one,2,3-dihydro-6-methoxyinden-1-one,1h-inden-1-one, 2,3-dihydro-6-methoxy,6-methoxyindanone,6-methoxy indanone,6-methoxy-1-indanon |
| IUPAC Name | 6-methoxy-2,3-dihydro-1H-inden-1-one |
| InChI Key | UJGDLLGKMWVCPT-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |