Organooxygen compounds
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Triethylene Glycol Diacetate 98.0+%, TCI America™
CAS: 111-21-7 Molecular Formula: C10H18O6 Molecular Weight (g/mol): 234.248 MDL Number: MFCD00026213 InChI Key: OVOUKWFJRHALDD-UHFFFAOYSA-N Synonym: triethylene glycol diacetate,tdac,triglycol diacetate,triethylene glycol, diacetate,triglycol, diacetate,acetic acid, triethylene glycol diester,triethyleneglycoldiacetate,2,2'-ethylenedioxy di ethyl acetate,ethanol, 2,2'-ethylenedioxydi-, diacetate,ethanol, 2,2'-1,2-ethanediylbis oxy bis-, diacetate PubChem CID: 8098 IUPAC Name: 2-[2-(2-acetyloxyethoxy)ethoxy]ethyl acetate SMILES: CC(=O)OCCOCCOCCOC(=O)C
| PubChem CID | 8098 |
|---|---|
| CAS | 111-21-7 |
| Molecular Weight (g/mol) | 234.248 |
| MDL Number | MFCD00026213 |
| SMILES | CC(=O)OCCOCCOCCOC(=O)C |
| Synonym | triethylene glycol diacetate,tdac,triglycol diacetate,triethylene glycol, diacetate,triglycol, diacetate,acetic acid, triethylene glycol diester,triethyleneglycoldiacetate,2,2'-ethylenedioxy di ethyl acetate,ethanol, 2,2'-ethylenedioxydi-, diacetate,ethanol, 2,2'-1,2-ethanediylbis oxy bis-, diacetate |
| IUPAC Name | 2-[2-(2-acetyloxyethoxy)ethoxy]ethyl acetate |
| InChI Key | OVOUKWFJRHALDD-UHFFFAOYSA-N |
| Molecular Formula | C10H18O6 |
2,6-Dimethoxynaphthalene 98.0+%, TCI America™
CAS: 5486-55-5 Molecular Formula: C12H12O2 Molecular Weight (g/mol): 188.23 MDL Number: MFCD00004063 InChI Key: AHKDVDYNDXGFPP-UHFFFAOYSA-N Synonym: naphthalene, 2,6-dimethoxy,2,6-dimethoxy-naphthalene,2,6-dimethoxy naphthalene,pubchem22734,naphthalene,6-dimethoxy,acmc-1ap1a,2,6-dimethoxynaphthalene PubChem CID: 79627 IUPAC Name: 2,6-dimethoxynaphthalene SMILES: COC1=CC2=CC=C(OC)C=C2C=C1
| PubChem CID | 79627 |
|---|---|
| CAS | 5486-55-5 |
| Molecular Weight (g/mol) | 188.23 |
| MDL Number | MFCD00004063 |
| SMILES | COC1=CC2=CC=C(OC)C=C2C=C1 |
| Synonym | naphthalene, 2,6-dimethoxy,2,6-dimethoxy-naphthalene,2,6-dimethoxy naphthalene,pubchem22734,naphthalene,6-dimethoxy,acmc-1ap1a,2,6-dimethoxynaphthalene |
| IUPAC Name | 2,6-dimethoxynaphthalene |
| InChI Key | AHKDVDYNDXGFPP-UHFFFAOYSA-N |
| Molecular Formula | C12H12O2 |
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 |
4-Methoxy-1-naphthaldehyde 97.0+%, TCI America™
CAS: 15971-29-6 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00004006 InChI Key: MVXMNHYVCLMLDD-UHFFFAOYSA-N Synonym: 4-methoxy-1-naphthaldehyde,4-methoxy-1-naphthalaldehyde,1-naphthalenecarboxaldehyde, 4-methoxy,4-methoxynaphthalenecarbaldehyde,pubchem16658,acmc-209dk5,ksc494i2d,1-naphthaldehyde, 4-methoxy,4-methoxy-1-naphthalenecarbaldehyde PubChem CID: 85217 IUPAC Name: 4-methoxynaphthalene-1-carbaldehyde SMILES: COC1=CC=C(C2=CC=CC=C21)C=O
| PubChem CID | 85217 |
|---|---|
| CAS | 15971-29-6 |
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD00004006 |
| SMILES | COC1=CC=C(C2=CC=CC=C21)C=O |
| Synonym | 4-methoxy-1-naphthaldehyde,4-methoxy-1-naphthalaldehyde,1-naphthalenecarboxaldehyde, 4-methoxy,4-methoxynaphthalenecarbaldehyde,pubchem16658,acmc-209dk5,ksc494i2d,1-naphthaldehyde, 4-methoxy,4-methoxy-1-naphthalenecarbaldehyde |
| IUPAC Name | 4-methoxynaphthalene-1-carbaldehyde |
| InChI Key | MVXMNHYVCLMLDD-UHFFFAOYSA-N |
| Molecular Formula | C12H10O2 |
Copper(I) Hexafluoro-2,4-pentanedionate 1,5-Cyclooctadiene Complex 95.0+%, TCI America™
CAS: 86233-74-1 Molecular Formula: C13H14CuF6O2 Molecular Weight (g/mol): 379.79 MDL Number: MFCD00156517 InChI Key: WSAPIYREFIKPSH-OJKFPHAYSA-N Synonym: copper i hexafluoro-2,4-pentanedionate-cyclooctadiene complex,copper i hexafluoroacetylacetonate cyclooctadiene complex PubChem CID: 92043567 IUPAC Name: (1Z,5Z)-cycloocta-1,5-diene (3Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one copper SMILES: [Cu].C1C\C=C/CC\C=C/1.O\C(=C/C(=O)C(F)(F)F)C(F)(F)F
| PubChem CID | 92043567 |
|---|---|
| CAS | 86233-74-1 |
| Molecular Weight (g/mol) | 379.79 |
| MDL Number | MFCD00156517 |
| SMILES | [Cu].C1C\C=C/CC\C=C/1.O\C(=C/C(=O)C(F)(F)F)C(F)(F)F |
| Synonym | copper i hexafluoro-2,4-pentanedionate-cyclooctadiene complex,copper i hexafluoroacetylacetonate cyclooctadiene complex |
| IUPAC Name | (1Z,5Z)-cycloocta-1,5-diene (3Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one copper |
| InChI Key | WSAPIYREFIKPSH-OJKFPHAYSA-N |
| Molecular Formula | C13H14CuF6O2 |
2',6'-Dichloro-3'-fluoroacetophenone 97.0+%, TCI America™
CAS: 290835-85-7 Molecular Formula: C8H5Cl2FO Molecular Weight (g/mol): 207.03 MDL Number: MFCD02093760 InChI Key: VJBFZHHRVCPAPZ-UHFFFAOYSA-N Synonym: 2',6'-dichloro-3'-fluoroacetophenone,1-2,6-dichloro-3-fluorophenyl ethanone,2,6-dichloro-3-fluoroacetophenone,1-2,6-dichloro-3-fluorophenyl ethan-1-one,2,6-dichloro-3-fluro acetophenone,2,6-dichloro-5-fluoro acetophenone,2',6'-dichloro-3'-fluroacetophenone,ethanone, 1-2,6-dichloro-3-fluorophenyl,1-acetyl-2,6-dichloro-3-fluorobenzene,pubchem8532 PubChem CID: 2733982 IUPAC Name: 1-(2,6-dichloro-3-fluorophenyl)ethan-1-one SMILES: CC(=O)C1=C(Cl)C=CC(F)=C1Cl
| PubChem CID | 2733982 |
|---|---|
| CAS | 290835-85-7 |
| Molecular Weight (g/mol) | 207.03 |
| MDL Number | MFCD02093760 |
| SMILES | CC(=O)C1=C(Cl)C=CC(F)=C1Cl |
| Synonym | 2',6'-dichloro-3'-fluoroacetophenone,1-2,6-dichloro-3-fluorophenyl ethanone,2,6-dichloro-3-fluoroacetophenone,1-2,6-dichloro-3-fluorophenyl ethan-1-one,2,6-dichloro-3-fluro acetophenone,2,6-dichloro-5-fluoro acetophenone,2',6'-dichloro-3'-fluroacetophenone,ethanone, 1-2,6-dichloro-3-fluorophenyl,1-acetyl-2,6-dichloro-3-fluorobenzene,pubchem8532 |
| IUPAC Name | 1-(2,6-dichloro-3-fluorophenyl)ethan-1-one |
| InChI Key | VJBFZHHRVCPAPZ-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl2FO |
2-Ethoxyethyl Benzoate 98.0+%, TCI America™
CAS: 5451-72-9 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00059371 InChI Key: KPHLTQOKDPSIGL-UHFFFAOYSA-N Synonym: Benzoic Acid 2-Ethoxyethyl Ester, Ethylene Glycol Monoethyl Ether Benzoate, Cellosolve Benzoate PubChem CID: 228742 IUPAC Name: 2-ethoxyethyl benzoate SMILES: CCOCCOC(=O)C1=CC=CC=C1
| PubChem CID | 228742 |
|---|---|
| CAS | 5451-72-9 |
| Molecular Weight (g/mol) | 194.23 |
| MDL Number | MFCD00059371 |
| SMILES | CCOCCOC(=O)C1=CC=CC=C1 |
| Synonym | Benzoic Acid 2-Ethoxyethyl Ester, Ethylene Glycol Monoethyl Ether Benzoate, Cellosolve Benzoate |
| IUPAC Name | 2-ethoxyethyl benzoate |
| InChI Key | KPHLTQOKDPSIGL-UHFFFAOYSA-N |
| Molecular Formula | C11H14O3 |
2-(Dimethylamino)-6-propionylnaphthalene 98.0+%, TCI America™
CAS: 70504-01-7 Molecular Formula: C15H17NO Molecular Weight (g/mol): 227.31 MDL Number: MFCD00056615 InChI Key: MPPQGYCZBNURDG-UHFFFAOYSA-N Synonym: Prodan PubChem CID: 107729 ChEBI: CHEBI:51909 IUPAC Name: 1-[6-(dimethylamino)naphthalen-2-yl]propan-1-one SMILES: CCC(=O)C1=CC=C2C=C(C=CC2=C1)N(C)C
| PubChem CID | 107729 |
|---|---|
| CAS | 70504-01-7 |
| Molecular Weight (g/mol) | 227.31 |
| ChEBI | CHEBI:51909 |
| MDL Number | MFCD00056615 |
| SMILES | CCC(=O)C1=CC=C2C=C(C=CC2=C1)N(C)C |
| Synonym | Prodan |
| IUPAC Name | 1-[6-(dimethylamino)naphthalen-2-yl]propan-1-one |
| InChI Key | MPPQGYCZBNURDG-UHFFFAOYSA-N |
| Molecular Formula | C15H17NO |
2,5-Dihydroxybenzaldehyde 98.0+%, TCI America™
CAS: 1194-98-5 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.12 MDL Number: MFCD00003333 InChI Key: CLFRCXCBWIQVRN-UHFFFAOYSA-N Synonym: gentisaldehyde,benzaldehyde, 2,5-dihydroxy,gentisate aldehyde,unii-0q83hds90w,polymer,2-formylhydroquinone,pubchem2285,acmc-1btnd,2,5 dihydroxybenzaldehyde,benzaldehyde,5-dihydroxy PubChem CID: 70949 ChEBI: CHEBI:28508 IUPAC Name: 2,5-dihydroxybenzaldehyde SMILES: OC1=CC=C(O)C(C=O)=C1
| PubChem CID | 70949 |
|---|---|
| CAS | 1194-98-5 |
| Molecular Weight (g/mol) | 138.12 |
| ChEBI | CHEBI:28508 |
| MDL Number | MFCD00003333 |
| SMILES | OC1=CC=C(O)C(C=O)=C1 |
| Synonym | gentisaldehyde,benzaldehyde, 2,5-dihydroxy,gentisate aldehyde,unii-0q83hds90w,polymer,2-formylhydroquinone,pubchem2285,acmc-1btnd,2,5 dihydroxybenzaldehyde,benzaldehyde,5-dihydroxy |
| IUPAC Name | 2,5-dihydroxybenzaldehyde |
| InChI Key | CLFRCXCBWIQVRN-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3 |
Triethyl Orthodichloroacetate, TCI America™
CAS: 54567-92-9 Molecular Formula: C8H16Cl2O3 Molecular Weight (g/mol): 231.113 MDL Number: MFCD01861293 InChI Key: ZKMPARWUDMKPMZ-UHFFFAOYSA-N Synonym: 1,1,1-Triethoxy-2,2-dichloroethane, Orthodichloroacetic Acid Triethyl Ester PubChem CID: 12723675 IUPAC Name: 2,2-dichloro-1,1,1-triethoxyethane SMILES: CCOC(C(Cl)Cl)(OCC)OCC
| PubChem CID | 12723675 |
|---|---|
| CAS | 54567-92-9 |
| Molecular Weight (g/mol) | 231.113 |
| MDL Number | MFCD01861293 |
| SMILES | CCOC(C(Cl)Cl)(OCC)OCC |
| Synonym | 1,1,1-Triethoxy-2,2-dichloroethane, Orthodichloroacetic Acid Triethyl Ester |
| IUPAC Name | 2,2-dichloro-1,1,1-triethoxyethane |
| InChI Key | ZKMPARWUDMKPMZ-UHFFFAOYSA-N |
| Molecular Formula | C8H16Cl2O3 |
4-Chloro-2-pyridinemethanol 98.0+%, TCI America™
CAS: 63071-10-3 Molecular Formula: C6H6ClNO Molecular Weight (g/mol): 143.57 MDL Number: MFCD07437885 InChI Key: UEAIOHHGRGSGGJ-UHFFFAOYSA-N Synonym: 4-Chloro-2-(hydroxymethyl)pyridine PubChem CID: 2763167 IUPAC Name: (4-chloropyridin-2-yl)methanol SMILES: C1=CN=C(C=C1Cl)CO
| PubChem CID | 2763167 |
|---|---|
| CAS | 63071-10-3 |
| Molecular Weight (g/mol) | 143.57 |
| MDL Number | MFCD07437885 |
| SMILES | C1=CN=C(C=C1Cl)CO |
| Synonym | 4-Chloro-2-(hydroxymethyl)pyridine |
| IUPAC Name | (4-chloropyridin-2-yl)methanol |
| InChI Key | UEAIOHHGRGSGGJ-UHFFFAOYSA-N |
| Molecular Formula | C6H6ClNO |
Benzyl Acetoacetate 95.0+%, TCI America™
CAS: 5396-89-4 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00008785 InChI Key: WOFAGNLBCJWEOE-UHFFFAOYSA-N Synonym: benzyl acetoacetate,acetoacetic acid benzyl ester,benzyl acetylacetate,acetoacetic acid, benzyl ester,phenylmethyl 3-oxobutanoate,butanoic acid, 3-oxo-, phenylmethyl ester,benzyl beta-ketobutyrate,ac-benzyl,unii-f9s0xgv18x,f9s0xgv18x PubChem CID: 142266 IUPAC Name: benzyl 3-oxobutanoate SMILES: CC(=O)CC(=O)OCC1=CC=CC=C1
| PubChem CID | 142266 |
|---|---|
| CAS | 5396-89-4 |
| Molecular Weight (g/mol) | 192.214 |
| MDL Number | MFCD00008785 |
| SMILES | CC(=O)CC(=O)OCC1=CC=CC=C1 |
| Synonym | benzyl acetoacetate,acetoacetic acid benzyl ester,benzyl acetylacetate,acetoacetic acid, benzyl ester,phenylmethyl 3-oxobutanoate,butanoic acid, 3-oxo-, phenylmethyl ester,benzyl beta-ketobutyrate,ac-benzyl,unii-f9s0xgv18x,f9s0xgv18x |
| IUPAC Name | benzyl 3-oxobutanoate |
| InChI Key | WOFAGNLBCJWEOE-UHFFFAOYSA-N |
| Molecular Formula | C11H12O3 |
2-Bromonicotinaldehyde 98.0+%, TCI America™
CAS: 128071-75-0 Molecular Formula: C6H4BrNO Molecular Weight (g/mol): 186.008 InChI Key: GNFWMEFWZWXLIN-UHFFFAOYSA-N Synonym: 2-bromonicotinaldehyde,2-bromo-3-formylpyridine,2-bromo-3-pyridinecarboxaldehyde,2-bromopyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-bromo,pubchem5057,acmc-1bypv,2-bromo-3-formyl pyridine,bromo-3-pyridine carbaldehyde,bromo-3-pyridinecarboxaldehyde PubChem CID: 4714951 IUPAC Name: 2-bromopyridine-3-carbaldehyde SMILES: C1=CC(=C(N=C1)Br)C=O
| PubChem CID | 4714951 |
|---|---|
| CAS | 128071-75-0 |
| Molecular Weight (g/mol) | 186.008 |
| SMILES | C1=CC(=C(N=C1)Br)C=O |
| Synonym | 2-bromonicotinaldehyde,2-bromo-3-formylpyridine,2-bromo-3-pyridinecarboxaldehyde,2-bromopyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-bromo,pubchem5057,acmc-1bypv,2-bromo-3-formyl pyridine,bromo-3-pyridine carbaldehyde,bromo-3-pyridinecarboxaldehyde |
| IUPAC Name | 2-bromopyridine-3-carbaldehyde |
| InChI Key | GNFWMEFWZWXLIN-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrNO |
4H-Indeno[1,2-b]thiophen-4-one 98.0+%, TCI America™
CAS: 5706-08-1 Molecular Formula: C11H6OS Molecular Weight (g/mol): 186.23 InChI Key: WSOJIQBCVMSHLB-UHFFFAOYSA-N PubChem CID: 12872762 IUPAC Name: indeno[1,2-b]thiophen-4-one SMILES: C1=CC=C2C(=C1)C3=C(C2=O)C=CS3
| PubChem CID | 12872762 |
|---|---|
| CAS | 5706-08-1 |
| Molecular Weight (g/mol) | 186.23 |
| SMILES | C1=CC=C2C(=C1)C3=C(C2=O)C=CS3 |
| IUPAC Name | indeno[1,2-b]thiophen-4-one |
| InChI Key | WSOJIQBCVMSHLB-UHFFFAOYSA-N |
| Molecular Formula | C11H6OS |
Hexanophenone 98.0+%, TCI America™
CAS: 942-92-7 Molecular Formula: C12H16O Molecular Weight (g/mol): 176.26 MDL Number: MFCD00009512 InChI Key: MAHPVQDVMLWUAG-UHFFFAOYSA-N Synonym: hexanophenone,caprophenone,1-hexanone, 1-phenyl,1-phenyl-1-hexanone,n-hexanophenone,amyl phenyl ketone,hexaphenone,pentyl phenyl ketone,4-ethylbutyrophenone,n-amylphenyl ketone PubChem CID: 70337 IUPAC Name: 1-phenylhexan-1-one SMILES: CCCCCC(=O)C1=CC=CC=C1
| PubChem CID | 70337 |
|---|---|
| CAS | 942-92-7 |
| Molecular Weight (g/mol) | 176.26 |
| MDL Number | MFCD00009512 |
| SMILES | CCCCCC(=O)C1=CC=CC=C1 |
| Synonym | hexanophenone,caprophenone,1-hexanone, 1-phenyl,1-phenyl-1-hexanone,n-hexanophenone,amyl phenyl ketone,hexaphenone,pentyl phenyl ketone,4-ethylbutyrophenone,n-amylphenyl ketone |
| IUPAC Name | 1-phenylhexan-1-one |
| InChI Key | MAHPVQDVMLWUAG-UHFFFAOYSA-N |
| Molecular Formula | C12H16O |