Organooxygen compounds
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4-Acetamidocyclohexanol (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 23363-88-4 Molecular Formula: C8H15NO2 Molecular Weight (g/mol): 157.21 MDL Number: MFCD06797038,MFCD00051422 InChI Key: HWAFCRWGGRVEQL-UHFFFAOYSA-N PubChem CID: 90074 IUPAC Name: N-(4-hydroxycyclohexyl)acetamide SMILES: CC(=O)NC1CCC(O)CC1
| PubChem CID | 90074 |
|---|---|
| CAS | 23363-88-4 |
| Molecular Weight (g/mol) | 157.21 |
| MDL Number | MFCD06797038,MFCD00051422 |
| SMILES | CC(=O)NC1CCC(O)CC1 |
| IUPAC Name | N-(4-hydroxycyclohexyl)acetamide |
| InChI Key | HWAFCRWGGRVEQL-UHFFFAOYSA-N |
| Molecular Formula | C8H15NO2 |
Diethyl Methyloxalacetate 96.0+%, TCI America™
CAS: 759-65-9 Molecular Formula: C9H14O5 Molecular Weight (g/mol): 202.206 MDL Number: MFCD00009163 InChI Key: OQOCQBJWOCRPQY-UHFFFAOYSA-N Synonym: Methyloxalacetic Acid Diethyl Ester, 2-Ethoxalylpropionic Acid Ethyl Ester, Ethyl 2-Ethoxalylpropionate PubChem CID: 97750 ChEBI: CHEBI:16879 IUPAC Name: diethyl 2-methyl-3-oxobutanedioate SMILES: CCOC(=O)C(C)C(=O)C(=O)OCC
| PubChem CID | 97750 |
|---|---|
| CAS | 759-65-9 |
| Molecular Weight (g/mol) | 202.206 |
| ChEBI | CHEBI:16879 |
| MDL Number | MFCD00009163 |
| SMILES | CCOC(=O)C(C)C(=O)C(=O)OCC |
| Synonym | Methyloxalacetic Acid Diethyl Ester, 2-Ethoxalylpropionic Acid Ethyl Ester, Ethyl 2-Ethoxalylpropionate |
| IUPAC Name | diethyl 2-methyl-3-oxobutanedioate |
| InChI Key | OQOCQBJWOCRPQY-UHFFFAOYSA-N |
| Molecular Formula | C9H14O5 |
5-(4-Nitrophenyl)-2-furaldehyde 98.0+%, TCI America™
CAS: 7147-77-5 Molecular Formula: C11H7NO4 Molecular Weight (g/mol): 217.18 MDL Number: MFCD00124191 InChI Key: RTSOJVJDKNKNFU-UHFFFAOYSA-N Synonym: 5-4-nitrophenyl-2-furaldehyde,5-4-nitrophenyl furan-2-carbaldehyde,5-4-nitrophenyl-2-furancarboxaldehyde,5-4-nitrophenyl furfural,5-4-nitro-phenyl-furan-2-carbaldehyde,2-furancarboxaldehyde, 5-4-nitrophenyl,5-p-nitrophenyl furfural,5-4-nitrophenyl 2-furaldehyde,cambridge id 5143178,acmc-1bl92 PubChem CID: 81567 IUPAC Name: 5-(4-nitrophenyl)furan-2-carbaldehyde SMILES: C1=CC(=CC=C1C2=CC=C(O2)C=O)[N+](=O)[O-]
| PubChem CID | 81567 |
|---|---|
| CAS | 7147-77-5 |
| Molecular Weight (g/mol) | 217.18 |
| MDL Number | MFCD00124191 |
| SMILES | C1=CC(=CC=C1C2=CC=C(O2)C=O)[N+](=O)[O-] |
| Synonym | 5-4-nitrophenyl-2-furaldehyde,5-4-nitrophenyl furan-2-carbaldehyde,5-4-nitrophenyl-2-furancarboxaldehyde,5-4-nitrophenyl furfural,5-4-nitro-phenyl-furan-2-carbaldehyde,2-furancarboxaldehyde, 5-4-nitrophenyl,5-p-nitrophenyl furfural,5-4-nitrophenyl 2-furaldehyde,cambridge id 5143178,acmc-1bl92 |
| IUPAC Name | 5-(4-nitrophenyl)furan-2-carbaldehyde |
| InChI Key | RTSOJVJDKNKNFU-UHFFFAOYSA-N |
| Molecular Formula | C11H7NO4 |
(S)-6,6'-Dibromo-2,2'-bis(methoxymethoxy)-1,1'-binaphthyl 98.0+%, TCI America™
CAS: 211560-97-3 Molecular Formula: C24H20Br2O4 Molecular Weight (g/mol): 532.228 MDL Number: MFCD03788936 InChI Key: UPLLZDVWXACTEG-UHFFFAOYSA-N PubChem CID: 10839989 IUPAC Name: 6-bromo-1-[6-bromo-2-(methoxymethoxy)naphthalen-1-yl]-2-(methoxymethoxy)naphthalene SMILES: COCOC1=C(C2=C(C=C1)C=C(C=C2)Br)C3=C(C=CC4=C3C=CC(=C4)Br)OCOC
| PubChem CID | 10839989 |
|---|---|
| CAS | 211560-97-3 |
| Molecular Weight (g/mol) | 532.228 |
| MDL Number | MFCD03788936 |
| SMILES | COCOC1=C(C2=C(C=C1)C=C(C=C2)Br)C3=C(C=CC4=C3C=CC(=C4)Br)OCOC |
| IUPAC Name | 6-bromo-1-[6-bromo-2-(methoxymethoxy)naphthalen-1-yl]-2-(methoxymethoxy)naphthalene |
| InChI Key | UPLLZDVWXACTEG-UHFFFAOYSA-N |
| Molecular Formula | C24H20Br2O4 |
Benzyl 2-Hydroxyphenyl Ketone 98.0+%, TCI America™
CAS: 2491-31-8 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.25 MDL Number: MFCD00218589 InChI Key: VGHVJQXWDXRTRJ-UHFFFAOYSA-N Synonym: 2′C-Hydroxy-2-phenylacetophenone PubChem CID: 137612 IUPAC Name: 1-(2-hydroxyphenyl)-2-phenylethan-1-one SMILES: OC1=CC=CC=C1C(=O)CC1=CC=CC=C1
| PubChem CID | 137612 |
|---|---|
| CAS | 2491-31-8 |
| Molecular Weight (g/mol) | 212.25 |
| MDL Number | MFCD00218589 |
| SMILES | OC1=CC=CC=C1C(=O)CC1=CC=CC=C1 |
| Synonym | 2′C-Hydroxy-2-phenylacetophenone |
| IUPAC Name | 1-(2-hydroxyphenyl)-2-phenylethan-1-one |
| InChI Key | VGHVJQXWDXRTRJ-UHFFFAOYSA-N |
| Molecular Formula | C14H12O2 |
Diethylene Glycol Ethyl Methyl Ether 98.0+%, TCI America™
CAS: 1002-67-1 Molecular Formula: C7H16O3 Molecular Weight (g/mol): 148.20 MDL Number: MFCD01727263 InChI Key: CNJRPYFBORAQAU-UHFFFAOYSA-N Synonym: 2,5,8-Trioxadecane, 1-Ethoxy-2-(2-methoxyethoxy)ethane PubChem CID: 13847 IUPAC Name: 1-ethoxy-2-(2-methoxyethoxy)ethane SMILES: CCOCCOCCOC
| PubChem CID | 13847 |
|---|---|
| CAS | 1002-67-1 |
| Molecular Weight (g/mol) | 148.20 |
| MDL Number | MFCD01727263 |
| SMILES | CCOCCOCCOC |
| Synonym | 2,5,8-Trioxadecane, 1-Ethoxy-2-(2-methoxyethoxy)ethane |
| IUPAC Name | 1-ethoxy-2-(2-methoxyethoxy)ethane |
| InChI Key | CNJRPYFBORAQAU-UHFFFAOYSA-N |
| Molecular Formula | C7H16O3 |
Dipropyl Malonate 98.0+%, TCI America™
CAS: 1117-19-7 Molecular Formula: C9H16O4 Molecular Weight (g/mol): 188.223 MDL Number: MFCD00059406 InChI Key: LWIWFCDNJNZEKB-UHFFFAOYSA-N Synonym: Malonic Acid Dipropyl Ester PubChem CID: 517959 IUPAC Name: dipropyl propanedioate SMILES: CCCOC(=O)CC(=O)OCCC
| PubChem CID | 517959 |
|---|---|
| CAS | 1117-19-7 |
| Molecular Weight (g/mol) | 188.223 |
| MDL Number | MFCD00059406 |
| SMILES | CCCOC(=O)CC(=O)OCCC |
| Synonym | Malonic Acid Dipropyl Ester |
| IUPAC Name | dipropyl propanedioate |
| InChI Key | LWIWFCDNJNZEKB-UHFFFAOYSA-N |
| Molecular Formula | C9H16O4 |
3,5-Dimethylcyclohexanol (mixture of isomers) 98.0+%, TCI America™
CAS: 5441-52-1 Molecular Formula: C8H16O Molecular Weight (g/mol): 128.215 MDL Number: MFCD00001447 InChI Key: WIYNOPYNRFPWNB-UHFFFAOYSA-N PubChem CID: 21584 IUPAC Name: 3,5-dimethylcyclohexan-1-ol SMILES: CC1CC(CC(C1)O)C
| PubChem CID | 21584 |
|---|---|
| CAS | 5441-52-1 |
| Molecular Weight (g/mol) | 128.215 |
| MDL Number | MFCD00001447 |
| SMILES | CC1CC(CC(C1)O)C |
| IUPAC Name | 3,5-dimethylcyclohexan-1-ol |
| InChI Key | WIYNOPYNRFPWNB-UHFFFAOYSA-N |
| Molecular Formula | C8H16O |
3-Morpholinone 98.0+%, TCI America™
CAS: 109-11-5 Molecular Formula: C4H7NO2 Molecular Weight (g/mol): 101.11 MDL Number: MFCD00631009 InChI Key: VSEAAEQOQBMPQF-UHFFFAOYSA-N Synonym: 3-morpholinone,3-ketomorpholine,morpholinone,morpholine-3-one,3-oxomorpholine,3-oxo-morpholine,acmc-1bpa5,ksc180o3n,morpholin-3-one; 3-morpholone PubChem CID: 66953 IUPAC Name: morpholin-3-one SMILES: O=C1COCCN1
| PubChem CID | 66953 |
|---|---|
| CAS | 109-11-5 |
| Molecular Weight (g/mol) | 101.11 |
| MDL Number | MFCD00631009 |
| SMILES | O=C1COCCN1 |
| Synonym | 3-morpholinone,3-ketomorpholine,morpholinone,morpholine-3-one,3-oxomorpholine,3-oxo-morpholine,acmc-1bpa5,ksc180o3n,morpholin-3-one; 3-morpholone |
| IUPAC Name | morpholin-3-one |
| InChI Key | VSEAAEQOQBMPQF-UHFFFAOYSA-N |
| Molecular Formula | C4H7NO2 |
Cyclobutyl Phenyl Ketone 95.0+%, TCI America™
CAS: 5407-98-7 Molecular Formula: C11H12O Molecular Weight (g/mol): 160.22 MDL Number: MFCD00001326 InChI Key: MVEBDOSCXOQNAR-UHFFFAOYSA-N Synonym: cyclobutyl phenyl ketone,cyclobutyl phenyl methanone,benzoylcyclobutane,cyclobutyl-phenyl-methanone,methanone, cyclobutylphenyl,cyclobutylphenylketone,cyclobutylphenylketon,phenyl cyclobutyl ketone,acmc-1aoiz,methanone,cyclobutylphenyl PubChem CID: 79414 IUPAC Name: cyclobutyl(phenyl)methanone SMILES: O=C(C1CCC1)C1=CC=CC=C1
| PubChem CID | 79414 |
|---|---|
| CAS | 5407-98-7 |
| Molecular Weight (g/mol) | 160.22 |
| MDL Number | MFCD00001326 |
| SMILES | O=C(C1CCC1)C1=CC=CC=C1 |
| Synonym | cyclobutyl phenyl ketone,cyclobutyl phenyl methanone,benzoylcyclobutane,cyclobutyl-phenyl-methanone,methanone, cyclobutylphenyl,cyclobutylphenylketone,cyclobutylphenylketon,phenyl cyclobutyl ketone,acmc-1aoiz,methanone,cyclobutylphenyl |
| IUPAC Name | cyclobutyl(phenyl)methanone |
| InChI Key | MVEBDOSCXOQNAR-UHFFFAOYSA-N |
| Molecular Formula | C11H12O |
1,3-Cyclopentanediol (cis- and trans- mixture) 95.0+%, TCI America™
CAS: 59719-74-3 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00001367 InChI Key: NUUPJBRGQCEZSI-UHFFFAOYSA-N Synonym: 1,3-cyclopentanediol,1,3-cyclopentanediol, cis,1,3-cyclopentanediol, mixture of cis and trans,1,3-cyclopentandiol,1,4-cyclopentanediol,cyclopentan-1,3-diol,3-hydroxy cylcopentanol,cyclopentane 1,3-diol,acmc-20ap4n,1,3-dihydroxycyclopentane PubChem CID: 100165 IUPAC Name: cyclopentane-1,3-diol SMILES: C1CC(CC1O)O
| PubChem CID | 100165 |
|---|---|
| CAS | 59719-74-3 |
| Molecular Weight (g/mol) | 102.133 |
| MDL Number | MFCD00001367 |
| SMILES | C1CC(CC1O)O |
| Synonym | 1,3-cyclopentanediol,1,3-cyclopentanediol, cis,1,3-cyclopentanediol, mixture of cis and trans,1,3-cyclopentandiol,1,4-cyclopentanediol,cyclopentan-1,3-diol,3-hydroxy cylcopentanol,cyclopentane 1,3-diol,acmc-20ap4n,1,3-dihydroxycyclopentane |
| IUPAC Name | cyclopentane-1,3-diol |
| InChI Key | NUUPJBRGQCEZSI-UHFFFAOYSA-N |
| Molecular Formula | C5H10O2 |
cis-1,2-Cyclohexanediol 98.0+%, TCI America™
CAS: 1792-81-0 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00064944 InChI Key: PFURGBBHAOXLIO-OLQVQODUSA-N Synonym: cis-1,2-cyclohexanediol,cis-cyclohexane-1,2-diol,grandidentol,cis-1,2-dihydroxycyclohexane,1r,2s-cyclohexane-1,2-diol,1,2-cyclohexanediol, cis,1,2-cyclohexanediol, cis-8ci 9ci,1,2-cyclohexanediol, 1r,2s-rel,cis-1,2-cyclohexandiol,1alpha,2alpha-cyclohexanediol PubChem CID: 92903 ChEBI: CHEBI:32329 IUPAC Name: (1R,2S)-cyclohexane-1,2-diol SMILES: C1CCC(C(C1)O)O
| PubChem CID | 92903 |
|---|---|
| CAS | 1792-81-0 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:32329 |
| MDL Number | MFCD00064944 |
| SMILES | C1CCC(C(C1)O)O |
| Synonym | cis-1,2-cyclohexanediol,cis-cyclohexane-1,2-diol,grandidentol,cis-1,2-dihydroxycyclohexane,1r,2s-cyclohexane-1,2-diol,1,2-cyclohexanediol, cis,1,2-cyclohexanediol, cis-8ci 9ci,1,2-cyclohexanediol, 1r,2s-rel,cis-1,2-cyclohexandiol,1alpha,2alpha-cyclohexanediol |
| IUPAC Name | (1R,2S)-cyclohexane-1,2-diol |
| InChI Key | PFURGBBHAOXLIO-OLQVQODUSA-N |
| Molecular Formula | C6H12O2 |
4-Chloro-4'-fluorobutyrophenone 97.0+%, TCI America™
CAS: 3874-54-2 Molecular Formula: C10H10ClFO Molecular Weight (g/mol): 200.637 MDL Number: MFCD00001007 InChI Key: HXAOUYGZEOZTJO-UHFFFAOYSA-N Synonym: 4-chloro-4'-fluorobutyrophenone,4-chloro-1-4-fluorophenyl butan-1-one,3-4-fluorobenzoyl propyl chloride,4-fluorobenzoylpropyl chloride,4-chloro-p-fluorobutyrophenone,3-chloropropyl 4-fluorophenyl ketone,1-butanone, 4-chloro-1-4-fluorophenyl,4'-fluoro-4-chlorobutyrophenone,p-fluorobenzoylpropyl chloride,p-fluoro-4-chlorobutyrophenone PubChem CID: 19750 IUPAC Name: 4-chloro-1-(4-fluorophenyl)butan-1-one SMILES: C1=CC(=CC=C1C(=O)CCCCl)F
| PubChem CID | 19750 |
|---|---|
| CAS | 3874-54-2 |
| Molecular Weight (g/mol) | 200.637 |
| MDL Number | MFCD00001007 |
| SMILES | C1=CC(=CC=C1C(=O)CCCCl)F |
| Synonym | 4-chloro-4'-fluorobutyrophenone,4-chloro-1-4-fluorophenyl butan-1-one,3-4-fluorobenzoyl propyl chloride,4-fluorobenzoylpropyl chloride,4-chloro-p-fluorobutyrophenone,3-chloropropyl 4-fluorophenyl ketone,1-butanone, 4-chloro-1-4-fluorophenyl,4'-fluoro-4-chlorobutyrophenone,p-fluorobenzoylpropyl chloride,p-fluoro-4-chlorobutyrophenone |
| IUPAC Name | 4-chloro-1-(4-fluorophenyl)butan-1-one |
| InChI Key | HXAOUYGZEOZTJO-UHFFFAOYSA-N |
| Molecular Formula | C10H10ClFO |
2,3-Dimethylanthraquinone 95.0+%, TCI America™
CAS: 6531-35-7 Molecular Formula: C16H12O2 Molecular Weight (g/mol): 236.27 InChI Key: KIJPZYXCIHZVGP-UHFFFAOYSA-N PubChem CID: 81019 IUPAC Name: 2,3-dimethylanthracene-9,10-dione SMILES: CC1=C(C=C2C(=C1)C(=O)C3=CC=CC=C3C2=O)C
| PubChem CID | 81019 |
|---|---|
| CAS | 6531-35-7 |
| Molecular Weight (g/mol) | 236.27 |
| SMILES | CC1=C(C=C2C(=C1)C(=O)C3=CC=CC=C3C2=O)C |
| IUPAC Name | 2,3-dimethylanthracene-9,10-dione |
| InChI Key | KIJPZYXCIHZVGP-UHFFFAOYSA-N |
| Molecular Formula | C16H12O2 |
2-Cyano-6-methoxybenzothiazole 97.0+%, TCI America™
CAS: 943-03-3 Molecular Formula: C9H6N2OS Molecular Weight (g/mol): 190.22 MDL Number: MFCD00010537 InChI Key: DEWDWBYQOFXKIH-UHFFFAOYSA-N Synonym: 2-cyano-6-methoxybenzothiazole,6-methoxybenzo d thiazole-2-carbonitrile,6-methoxy-2-benzothiazolecarbonitrile,6-methoxybenzothiazole-2-carbonitrile,6-methoxy-benzothiazole-2-carbonitrile,6-methoxy-2-cyano-benzothiazole,2-benzothiazolecarbonitrile, 6-methoxy,pubchem9766,acmc-209rr8,ksc486m5p PubChem CID: 342109 IUPAC Name: 6-methoxy-1,3-benzothiazole-2-carbonitrile SMILES: COC1=CC2=C(C=C1)N=C(S2)C#N
| PubChem CID | 342109 |
|---|---|
| CAS | 943-03-3 |
| Molecular Weight (g/mol) | 190.22 |
| MDL Number | MFCD00010537 |
| SMILES | COC1=CC2=C(C=C1)N=C(S2)C#N |
| Synonym | 2-cyano-6-methoxybenzothiazole,6-methoxybenzo d thiazole-2-carbonitrile,6-methoxy-2-benzothiazolecarbonitrile,6-methoxybenzothiazole-2-carbonitrile,6-methoxy-benzothiazole-2-carbonitrile,6-methoxy-2-cyano-benzothiazole,2-benzothiazolecarbonitrile, 6-methoxy,pubchem9766,acmc-209rr8,ksc486m5p |
| IUPAC Name | 6-methoxy-1,3-benzothiazole-2-carbonitrile |
| InChI Key | DEWDWBYQOFXKIH-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2OS |