Organooxygen compounds
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2'-Acetoxyacetophenone 98.0+%, TCI America™
CAS: 7250-94-4 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.19 MDL Number: MFCD00017223 InChI Key: WWEDAIJJBDFOOK-UHFFFAOYSA-N Synonym: 2'-acetoxyacetophenone,2-acetylphenyl acetate,ethanone, 1-2-acetyloxy phenyl,o-acetoxyacetophenone,2'-acetoxy acetophenone,maybridge1_002653,acmc-209on8,acetic acid 2-acetyl-phenyl ester,acetophenone, 2-hydroxy-, acetate 8ci PubChem CID: 16716 IUPAC Name: 2-acetylphenyl acetate SMILES: CC(=O)OC1=CC=CC=C1C(C)=O
| PubChem CID | 16716 |
|---|---|
| CAS | 7250-94-4 |
| Molecular Weight (g/mol) | 178.19 |
| MDL Number | MFCD00017223 |
| SMILES | CC(=O)OC1=CC=CC=C1C(C)=O |
| Synonym | 2'-acetoxyacetophenone,2-acetylphenyl acetate,ethanone, 1-2-acetyloxy phenyl,o-acetoxyacetophenone,2'-acetoxy acetophenone,maybridge1_002653,acmc-209on8,acetic acid 2-acetyl-phenyl ester,acetophenone, 2-hydroxy-, acetate 8ci |
| IUPAC Name | 2-acetylphenyl acetate |
| InChI Key | WWEDAIJJBDFOOK-UHFFFAOYSA-N |
| Molecular Formula | C10H10O3 |
Diethyl Propylmalonate 98.0+%, TCI America™
CAS: 2163-48-6 Molecular Formula: C10H18O4 Molecular Weight (g/mol): 202.25 MDL Number: MFCD00009168 InChI Key: GRRSDGHTSMJICM-UHFFFAOYSA-N Synonym: diethyl propylmalonate,diethyl 2-propylmalonate,1,3-diethyl 2-propylpropanedioate,diethyl n-propylmalonate,diethylpropylmalonate,propylmalonic acid diethyl ester,propanedioic acid, propyl-, diethyl ester,diethyl-n-propylmalonate,malonic acid, propyl-, diethyl ester,diethyl propyl malonate PubChem CID: 16552 IUPAC Name: diethyl 2-propylpropanedioate SMILES: CCCC(C(=O)OCC)C(=O)OCC
| PubChem CID | 16552 |
|---|---|
| CAS | 2163-48-6 |
| Molecular Weight (g/mol) | 202.25 |
| MDL Number | MFCD00009168 |
| SMILES | CCCC(C(=O)OCC)C(=O)OCC |
| Synonym | diethyl propylmalonate,diethyl 2-propylmalonate,1,3-diethyl 2-propylpropanedioate,diethyl n-propylmalonate,diethylpropylmalonate,propylmalonic acid diethyl ester,propanedioic acid, propyl-, diethyl ester,diethyl-n-propylmalonate,malonic acid, propyl-, diethyl ester,diethyl propyl malonate |
| IUPAC Name | diethyl 2-propylpropanedioate |
| InChI Key | GRRSDGHTSMJICM-UHFFFAOYSA-N |
| Molecular Formula | C10H18O4 |
Isophthalaldehydic Acid 98.0+%, TCI America™
CAS: 619-21-6 Molecular Formula: C8H6O3 Molecular Weight (g/mol): 150.133 MDL Number: MFCD00039575 InChI Key: UHDNUPHSDMOGCR-UHFFFAOYSA-N Synonym: 3-carboxybenzaldehyde,benzoic acid, 3-formyl,m-formyl benzoic acid,3-formyl benzoic acid,3-formyl-benzoic acid,unii-hb95grm95d,m-carboxybenzaldehyde,hb95grm95d,3-formylbenzoicacid,isophthalaldehydsaure PubChem CID: 12077 IUPAC Name: 3-formylbenzoic acid SMILES: C1=CC(=CC(=C1)C(=O)O)C=O
| PubChem CID | 12077 |
|---|---|
| CAS | 619-21-6 |
| Molecular Weight (g/mol) | 150.133 |
| MDL Number | MFCD00039575 |
| SMILES | C1=CC(=CC(=C1)C(=O)O)C=O |
| Synonym | 3-carboxybenzaldehyde,benzoic acid, 3-formyl,m-formyl benzoic acid,3-formyl benzoic acid,3-formyl-benzoic acid,unii-hb95grm95d,m-carboxybenzaldehyde,hb95grm95d,3-formylbenzoicacid,isophthalaldehydsaure |
| IUPAC Name | 3-formylbenzoic acid |
| InChI Key | UHDNUPHSDMOGCR-UHFFFAOYSA-N |
| Molecular Formula | C8H6O3 |
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 |
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 |
Diethylene Glycol Monohexyl Ether 98.0+%, TCI America™
CAS: 112-59-4 Molecular Formula: C10H22O3 Molecular Weight (g/mol): 190.28 MDL Number: MFCD00010703 InChI Key: GZMAAYIALGURDQ-UHFFFAOYSA-N Synonym: diethylene glycol monohexyl ether,2-2-hexyloxyethoxy ethanol,hexol carbitol,hexyl carbitol,n-hexyl carbitol,n-hexoxyethoxyethanol,3,6-dioxadodecanol-1,ethanol, 2-2-hexyloxy ethoxy,hexyldiglycol,hexylkarbitol PubChem CID: 8199 IUPAC Name: 2-[2-(hexyloxy)ethoxy]ethan-1-ol SMILES: CCCCCCOCCOCCO
| PubChem CID | 8199 |
|---|---|
| CAS | 112-59-4 |
| Molecular Weight (g/mol) | 190.28 |
| MDL Number | MFCD00010703 |
| SMILES | CCCCCCOCCOCCO |
| Synonym | diethylene glycol monohexyl ether,2-2-hexyloxyethoxy ethanol,hexol carbitol,hexyl carbitol,n-hexyl carbitol,n-hexoxyethoxyethanol,3,6-dioxadodecanol-1,ethanol, 2-2-hexyloxy ethoxy,hexyldiglycol,hexylkarbitol |
| IUPAC Name | 2-[2-(hexyloxy)ethoxy]ethan-1-ol |
| InChI Key | GZMAAYIALGURDQ-UHFFFAOYSA-N |
| Molecular Formula | C10H22O3 |
Methylionone (mixture of alpha- and beta-, predominantly alpha-n-isomer) 80.0+%, TCI America™
CAS: 7779-30-8 Molecular Formula: C14H22O Molecular Weight (g/mol): 206.329 MDL Number: MFCD00031478 InChI Key: VPKMGDRERYMTJX-CMDGGOBGSA-N PubChem CID: 5371084 IUPAC Name: (E)-1-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-1-en-3-one SMILES: CCC(=O)C=CC1C(=CCCC1(C)C)C
| PubChem CID | 5371084 |
|---|---|
| CAS | 7779-30-8 |
| Molecular Weight (g/mol) | 206.329 |
| MDL Number | MFCD00031478 |
| SMILES | CCC(=O)C=CC1C(=CCCC1(C)C)C |
| IUPAC Name | (E)-1-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-1-en-3-one |
| InChI Key | VPKMGDRERYMTJX-CMDGGOBGSA-N |
| Molecular Formula | C14H22O |
2'-Hydroxy-5'-nitroacetophenone 98.0+%, TCI America™
CAS: 1450-76-6 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00463816 InChI Key: LNCBPUWMGYOISS-UHFFFAOYSA-N PubChem CID: 248079 SMILES: CC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])O
| PubChem CID | 248079 |
|---|---|
| CAS | 1450-76-6 |
| Molecular Weight (g/mol) | 181.147 |
| MDL Number | MFCD00463816 |
| SMILES | CC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])O |
| InChI Key | LNCBPUWMGYOISS-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
Polyethylene Glycol Monostearate (n=approx. 55) (palmitate and stearate mixture), TCI America™
CAS: 9004-99-3 Molecular Formula: C20H40O3 Molecular Weight (g/mol): 328.537 MDL Number: MFCD00148007 InChI Key: RFVNOJDQRGSOEL-UHFFFAOYSA-N PubChem CID: 24762 IUPAC Name: 2-hydroxyethyl octadecanoate SMILES: CCCCCCCCCCCCCCCCCC(=O)OCCO
| PubChem CID | 24762 |
|---|---|
| CAS | 9004-99-3 |
| Molecular Weight (g/mol) | 328.537 |
| MDL Number | MFCD00148007 |
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCCO |
| IUPAC Name | 2-hydroxyethyl octadecanoate |
| InChI Key | RFVNOJDQRGSOEL-UHFFFAOYSA-N |
| Molecular Formula | C20H40O3 |
3-Nonen-2-one 96.0+%, TCI America™
CAS: 14309-57-0 Molecular Formula: C9H16O Molecular Weight (g/mol): 140.23 MDL Number: MFCD00010241 InChI Key: HDKLIZDXVUCLHQ-BQYQJAHWSA-N Synonym: 3-nonen-2-one,trans-3-nonen-2-one,e-non-3-en-2-one,e-3-nonen-2-one,3-nonen-2-one, 3e,3e-3-nonen-2-one,3e-non-3-en-2-one,unii-fr0k39of16,3e-nonen-2-one,3-nonen-2-one fhfi PubChem CID: 5317045 IUPAC Name: (3E)-non-3-en-2-one SMILES: CCCCC\C=C\C(C)=O
| PubChem CID | 5317045 |
|---|---|
| CAS | 14309-57-0 |
| Molecular Weight (g/mol) | 140.23 |
| MDL Number | MFCD00010241 |
| SMILES | CCCCC\C=C\C(C)=O |
| Synonym | 3-nonen-2-one,trans-3-nonen-2-one,e-non-3-en-2-one,e-3-nonen-2-one,3-nonen-2-one, 3e,3e-3-nonen-2-one,3e-non-3-en-2-one,unii-fr0k39of16,3e-nonen-2-one,3-nonen-2-one fhfi |
| IUPAC Name | (3E)-non-3-en-2-one |
| InChI Key | HDKLIZDXVUCLHQ-BQYQJAHWSA-N |
| Molecular Formula | C9H16O |
7-Methoxy-1-naphthaleneacetic Acid 98.0+%, TCI America™
CAS: 6836-22-2 Molecular Formula: C13H12O3 Molecular Weight (g/mol): 216.236 MDL Number: MFCD12756806 InChI Key: GJPYHKXILUFWKV-UHFFFAOYSA-N Synonym: (7-Methoxy-1-naphthyl)acetic Acid PubChem CID: 13570105 IUPAC Name: 2-(7-methoxynaphthalen-1-yl)acetic acid SMILES: COC1=CC2=C(C=CC=C2CC(=O)O)C=C1
| PubChem CID | 13570105 |
|---|---|
| CAS | 6836-22-2 |
| Molecular Weight (g/mol) | 216.236 |
| MDL Number | MFCD12756806 |
| SMILES | COC1=CC2=C(C=CC=C2CC(=O)O)C=C1 |
| Synonym | (7-Methoxy-1-naphthyl)acetic Acid |
| IUPAC Name | 2-(7-methoxynaphthalen-1-yl)acetic acid |
| InChI Key | GJPYHKXILUFWKV-UHFFFAOYSA-N |
| Molecular Formula | C13H12O3 |
Diisobutyl Ether 98.0+%, TCI America™
CAS: 628-55-7 Molecular Formula: C8H18O Molecular Weight (g/mol): 130.23 MDL Number: MFCD00008935 InChI Key: SZNYYWIUQFZLLT-UHFFFAOYSA-N Synonym: Isobutyl Ether PubChem CID: 12346 IUPAC Name: 2-methyl-1-(2-methylpropoxy)propane SMILES: CC(C)COCC(C)C
| PubChem CID | 12346 |
|---|---|
| CAS | 628-55-7 |
| Molecular Weight (g/mol) | 130.23 |
| MDL Number | MFCD00008935 |
| SMILES | CC(C)COCC(C)C |
| Synonym | Isobutyl Ether |
| IUPAC Name | 2-methyl-1-(2-methylpropoxy)propane |
| InChI Key | SZNYYWIUQFZLLT-UHFFFAOYSA-N |
| Molecular Formula | C8H18O |
2'-Aminoacetophenone, TCI America™
CAS: 551-93-9 Molecular Formula: C8H9NO Molecular Weight (g/mol): 135.17 MDL Number: MFCD00007717 InChI Key: GTDQGKWDWVUKTI-UHFFFAOYSA-N Synonym: 2'-aminoacetophenone,1-2-aminophenyl ethanone,o-aminoacetophenone,2-acetylaniline,o-acetylaniline,o-aminoacetylbenzene,1-acetyl-2-aminobenzene,1-2-aminophenyl ethan-1-one,acetophenone, 2'-amino,ethanone, 1-2-aminophenyl PubChem CID: 11086 IUPAC Name: 1-(2-aminophenyl)ethan-1-one SMILES: CC(=O)C1=CC=CC=C1N
| PubChem CID | 11086 |
|---|---|
| CAS | 551-93-9 |
| Molecular Weight (g/mol) | 135.17 |
| MDL Number | MFCD00007717 |
| SMILES | CC(=O)C1=CC=CC=C1N |
| Synonym | 2'-aminoacetophenone,1-2-aminophenyl ethanone,o-aminoacetophenone,2-acetylaniline,o-acetylaniline,o-aminoacetylbenzene,1-acetyl-2-aminobenzene,1-2-aminophenyl ethan-1-one,acetophenone, 2'-amino,ethanone, 1-2-aminophenyl |
| IUPAC Name | 1-(2-aminophenyl)ethan-1-one |
| InChI Key | GTDQGKWDWVUKTI-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO |
2-Chlorocyclohexanol 95.0+%, TCI America™
CAS: 1561-86-0 Molecular Formula: C6H11ClO Molecular Weight (g/mol): 134.603 MDL Number: MFCD00003860 InChI Key: NYEWDMNOXFGGDX-UHFFFAOYSA-N Synonym: 2-chlorocyclohexanol,cyclohexanol, 2-chloro,cyclohexene chlorohydrin,2-chlor-cyclohexanol,acmc-209ddc,2-chloro-cyclohexan-1-ol,2-chlorocyclohexanol, technical grade PubChem CID: 15274 IUPAC Name: 2-chlorocyclohexan-1-ol SMILES: C1CCC(C(C1)O)Cl
| PubChem CID | 15274 |
|---|---|
| CAS | 1561-86-0 |
| Molecular Weight (g/mol) | 134.603 |
| MDL Number | MFCD00003860 |
| SMILES | C1CCC(C(C1)O)Cl |
| Synonym | 2-chlorocyclohexanol,cyclohexanol, 2-chloro,cyclohexene chlorohydrin,2-chlor-cyclohexanol,acmc-209ddc,2-chloro-cyclohexan-1-ol,2-chlorocyclohexanol, technical grade |
| IUPAC Name | 2-chlorocyclohexan-1-ol |
| InChI Key | NYEWDMNOXFGGDX-UHFFFAOYSA-N |
| Molecular Formula | C6H11ClO |