Organooxygen compounds
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3,4-Dibenzyloxybenzaldehyde 98.0+%, TCI America™
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CAS: 5447-02-9 Molecular Formula: C21H18O3 Molecular Weight (g/mol): 318.37 MDL Number: MFCD00004776 InChI Key: XDDLXZHBWVFPRG-UHFFFAOYSA-N Synonym: 3,4-Bis(benzyloxy)benzaldehyde PubChem CID: 79526 IUPAC Name: 3,4-bis(phenylmethoxy)benzaldehyde SMILES: C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=O)OCC3=CC=CC=C3
| PubChem CID | 79526 |
|---|---|
| CAS | 5447-02-9 |
| Molecular Weight (g/mol) | 318.37 |
| MDL Number | MFCD00004776 |
| SMILES | C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=O)OCC3=CC=CC=C3 |
| Synonym | 3,4-Bis(benzyloxy)benzaldehyde |
| IUPAC Name | 3,4-bis(phenylmethoxy)benzaldehyde |
| InChI Key | XDDLXZHBWVFPRG-UHFFFAOYSA-N |
| Molecular Formula | C21H18O3 |
5-Bromoisatin 97.0+%, TCI America™
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CAS: 87-48-9 Molecular Formula: C8H4BrNO2 Molecular Weight (g/mol): 226.029 MDL Number: MFCD00005719 InChI Key: MBVCESWADCIXJN-UHFFFAOYSA-N Synonym: 5-bromoisatin,5-bromoindoline-2,3-dione,5-bromoindole-2,3-dione,isatin, 5-bromo,5-bromisatin,1h-indole-2,3-dione, 5-bromo,5-bromisatin czech,5-bromo-2,3-dihydro-1h-indole-2,3-dione,indole-2,3-dione, 5-bromo,5-bromoisatin monohydrate PubChem CID: 6889 IUPAC Name: 5-bromo-1H-indole-2,3-dione SMILES: C1=CC2=C(C=C1Br)C(=O)C(=O)N2
| PubChem CID | 6889 |
|---|---|
| CAS | 87-48-9 |
| Molecular Weight (g/mol) | 226.029 |
| MDL Number | MFCD00005719 |
| SMILES | C1=CC2=C(C=C1Br)C(=O)C(=O)N2 |
| Synonym | 5-bromoisatin,5-bromoindoline-2,3-dione,5-bromoindole-2,3-dione,isatin, 5-bromo,5-bromisatin,1h-indole-2,3-dione, 5-bromo,5-bromisatin czech,5-bromo-2,3-dihydro-1h-indole-2,3-dione,indole-2,3-dione, 5-bromo,5-bromoisatin monohydrate |
| IUPAC Name | 5-bromo-1H-indole-2,3-dione |
| InChI Key | MBVCESWADCIXJN-UHFFFAOYSA-N |
| Molecular Formula | C8H4BrNO2 |
1,3-Butanediol 99.0+%, TCI America™
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CAS: 107-88-0 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.122 MDL Number: MFCD00004554 InChI Key: PUPZLCDOIYMWBV-UHFFFAOYSA-N Synonym: 1,3-butanediol,1,3-butylene glycol,1,3-dihydroxybutane,methyltrimethylene glycol,1,3-butandiol,1-methyl-1,3-propanediol,beta-butylene glycol,1,3 butylene glycol,1,3-butylenglykol,rs-1,3-butandiol PubChem CID: 7896 ChEBI: CHEBI:52683 IUPAC Name: butane-1,3-diol SMILES: CC(CCO)O
| PubChem CID | 7896 |
|---|---|
| CAS | 107-88-0 |
| Molecular Weight (g/mol) | 90.122 |
| ChEBI | CHEBI:52683 |
| MDL Number | MFCD00004554 |
| SMILES | CC(CCO)O |
| Synonym | 1,3-butanediol,1,3-butylene glycol,1,3-dihydroxybutane,methyltrimethylene glycol,1,3-butandiol,1-methyl-1,3-propanediol,beta-butylene glycol,1,3 butylene glycol,1,3-butylenglykol,rs-1,3-butandiol |
| IUPAC Name | butane-1,3-diol |
| InChI Key | PUPZLCDOIYMWBV-UHFFFAOYSA-N |
| Molecular Formula | C4H10O2 |
8-Hydroxy-1,1,7,7-tetramethyljulolidine-9-carboxaldehyde 98.0+%, TCI America™
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CAS: 115662-09-4 Molecular Formula: C17H23NO2 Molecular Weight (g/mol): 273.38 MDL Number: MFCD00142785 InChI Key: ZBVWJSQPIHQKQJ-UHFFFAOYSA-N Synonym: 8-hydroxy-1,1,7,7-tetramethyljulolidine-9-carboxaldehyde,9-formyl-8-hydroxy-1,1,7,7-tetramethyljulolidine,8-hydroxy-1,1,7,7-tetramethyl-2,3,6,7-tetrahydro-1h,5h-pyrido 3,2,1-ij quinoline-9-carbaldehyde,1,1,7,7-tetramethyl-8-hydroxy-9-formyljulolidine,8-hydroxy-1,1,7,7-tetramethyl-2,3,6,7-tetrahydro-1h,5h-pyrido 3,2,1-ij quinoline-9-carboxaldehyde,8-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo 7.3.1.0?, 1 3 trideca-5,7,9 13-triene-7-carbaldehyde,pubchem13976,1,1,7,7-tetrametyl-8-hydroxy-9-formyljulolidine,8-hydroxy-1,1,7,7-tetramethyljulolidine-9-carbaldehyde PubChem CID: 737089 IUPAC Name: 6-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.0⁵,¹³]trideca-5,7,9(13)-triene-7-carbaldehyde SMILES: CC1(C)CCN2CCC(C)(C)C3=C(O)C(C=O)=CC1=C23
| PubChem CID | 737089 |
|---|---|
| CAS | 115662-09-4 |
| Molecular Weight (g/mol) | 273.38 |
| MDL Number | MFCD00142785 |
| SMILES | CC1(C)CCN2CCC(C)(C)C3=C(O)C(C=O)=CC1=C23 |
| Synonym | 8-hydroxy-1,1,7,7-tetramethyljulolidine-9-carboxaldehyde,9-formyl-8-hydroxy-1,1,7,7-tetramethyljulolidine,8-hydroxy-1,1,7,7-tetramethyl-2,3,6,7-tetrahydro-1h,5h-pyrido 3,2,1-ij quinoline-9-carbaldehyde,1,1,7,7-tetramethyl-8-hydroxy-9-formyljulolidine,8-hydroxy-1,1,7,7-tetramethyl-2,3,6,7-tetrahydro-1h,5h-pyrido 3,2,1-ij quinoline-9-carboxaldehyde,8-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo 7.3.1.0?, 1 3 trideca-5,7,9 13-triene-7-carbaldehyde,pubchem13976,1,1,7,7-tetrametyl-8-hydroxy-9-formyljulolidine,8-hydroxy-1,1,7,7-tetramethyljulolidine-9-carbaldehyde |
| IUPAC Name | 6-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.0⁵,¹³]trideca-5,7,9(13)-triene-7-carbaldehyde |
| InChI Key | ZBVWJSQPIHQKQJ-UHFFFAOYSA-N |
| Molecular Formula | C17H23NO2 |
Ethyl Diformylacetate 97.0+%, TCI America™
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CAS: 80370-42-9 Molecular Formula: C6H8O4 Molecular Weight (g/mol): 144.126 MDL Number: MFCD11112084 InChI Key: HMFLBGNCDZYITR-UHFFFAOYSA-N Synonym: Diformylacetic Acid Ethyl Ester, Ethyl 2-Formyl-3-oxopropionate, 2-Formyl-3-oxopropionic Acid Ethyl Ester PubChem CID: 11029955 IUPAC Name: ethyl 2-formyl-3-oxopropanoate SMILES: CCOC(=O)C(C=O)C=O
| PubChem CID | 11029955 |
|---|---|
| CAS | 80370-42-9 |
| Molecular Weight (g/mol) | 144.126 |
| MDL Number | MFCD11112084 |
| SMILES | CCOC(=O)C(C=O)C=O |
| Synonym | Diformylacetic Acid Ethyl Ester, Ethyl 2-Formyl-3-oxopropionate, 2-Formyl-3-oxopropionic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-formyl-3-oxopropanoate |
| InChI Key | HMFLBGNCDZYITR-UHFFFAOYSA-N |
| Molecular Formula | C6H8O4 |
5-Formyl-2-furanboronic Acid (contains varying amounts of Anhydride), TCI America™
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| PubChem CID | 2734355 |
|---|---|
| CAS | 27329-70-0 |
| Molecular Weight (g/mol) | 139.901 |
| MDL Number | MFCD01114696 |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=CC=C(O1)C=O)(O)O |
| TSCA | No |
| IUPAC Name | (5-formylfuran-2-yl)boronic acid |
| InChI Key | JUWYQISLQJRRNT-UHFFFAOYSA-N |
| Molecular Formula | C5H5BO4 |
| Formula Weight | 139.90 |
| Melting Point | 151°C |
2-Benzyloxybenzaldehyde 98.0+%, TCI America™
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CAS: 5896-17-3 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.25 MDL Number: MFCD00016583 InChI Key: PBEJTRAJWCNHRS-UHFFFAOYSA-N Synonym: 2-benzyloxy benzaldehyde,2-benzyloxybenzaldehyde,benzaldehyde, 2-phenylmethoxy,o-benzyloxy benzaldehyde,benzaldehyde, o-benzyloxy,o-benzylsalicylaldehyde,2-benzyl-oxy benzaldehyde,2-phenylmethoxy benzaldehyde,benzyloxybenzaldehyde,o-benzyloxybenzaldehyde PubChem CID: 344784 IUPAC Name: 2-(benzyloxy)benzaldehyde SMILES: O=CC1=CC=CC=C1OCC1=CC=CC=C1
| PubChem CID | 344784 |
|---|---|
| CAS | 5896-17-3 |
| Molecular Weight (g/mol) | 212.25 |
| MDL Number | MFCD00016583 |
| SMILES | O=CC1=CC=CC=C1OCC1=CC=CC=C1 |
| Synonym | 2-benzyloxy benzaldehyde,2-benzyloxybenzaldehyde,benzaldehyde, 2-phenylmethoxy,o-benzyloxy benzaldehyde,benzaldehyde, o-benzyloxy,o-benzylsalicylaldehyde,2-benzyl-oxy benzaldehyde,2-phenylmethoxy benzaldehyde,benzyloxybenzaldehyde,o-benzyloxybenzaldehyde |
| IUPAC Name | 2-(benzyloxy)benzaldehyde |
| InChI Key | PBEJTRAJWCNHRS-UHFFFAOYSA-N |
| Molecular Formula | C14H12O2 |
2,3-Bis(hydroxymethyl)naphthalene 98.0+%, TCI America™
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CAS: 31554-15-1 Molecular Formula: C12H12O2 Molecular Weight (g/mol): 188.226 MDL Number: MFCD00191314 InChI Key: DTYJRRQQOLBRGH-UHFFFAOYSA-N PubChem CID: 598417 IUPAC Name: [3-(hydroxymethyl)naphthalen-2-yl]methanol SMILES: C1=CC=C2C=C(C(=CC2=C1)CO)CO
| PubChem CID | 598417 |
|---|---|
| CAS | 31554-15-1 |
| Molecular Weight (g/mol) | 188.226 |
| MDL Number | MFCD00191314 |
| SMILES | C1=CC=C2C=C(C(=CC2=C1)CO)CO |
| IUPAC Name | [3-(hydroxymethyl)naphthalen-2-yl]methanol |
| InChI Key | DTYJRRQQOLBRGH-UHFFFAOYSA-N |
| Molecular Formula | C12H12O2 |
(R)-(-)-2,2-Dimethyl-1,3-dioxolane-4-methanol 97.0+%, TCI America™
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CAS: 14347-78-5 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.159 MDL Number: MFCD00003213 InChI Key: RNVYQYLELCKWAN-RXMQYKEDSA-N Synonym: r---2,2-dimethyl-1,3-dioxolane-4-methanol,r-2,2-dimethyl-1,3-dioxolan-4-yl methanol,4r-2,2-dimethyl-1,3-dioxolan-4-yl methanol,r-solketal,r---1,2-o-isopropylideneglycerol,r-2,2-dimethyl-1,3-dioxolane-4-methanol,2,3-o-isopropylidene-sn-glycerol,d-acetone glycerol,l---1,2-isopropylideneglycerol,r---2,3-o-isopropylideneglycerol PubChem CID: 736056 IUPAC Name: [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol SMILES: CC1(OCC(O1)CO)C
| PubChem CID | 736056 |
|---|---|
| CAS | 14347-78-5 |
| Molecular Weight (g/mol) | 132.159 |
| MDL Number | MFCD00003213 |
| SMILES | CC1(OCC(O1)CO)C |
| Synonym | r---2,2-dimethyl-1,3-dioxolane-4-methanol,r-2,2-dimethyl-1,3-dioxolan-4-yl methanol,4r-2,2-dimethyl-1,3-dioxolan-4-yl methanol,r-solketal,r---1,2-o-isopropylideneglycerol,r-2,2-dimethyl-1,3-dioxolane-4-methanol,2,3-o-isopropylidene-sn-glycerol,d-acetone glycerol,l---1,2-isopropylideneglycerol,r---2,3-o-isopropylideneglycerol |
| IUPAC Name | [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol |
| InChI Key | RNVYQYLELCKWAN-RXMQYKEDSA-N |
| Molecular Formula | C6H12O3 |
2',6'-Dichloro-3'-fluoroacetophenone 97.0+%, TCI America™
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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-Benzoylpyridine 99.0+%, TCI America™
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CAS: 91-02-1 Molecular Formula: C12H9NO Molecular Weight (g/mol): 183.21 MDL Number: MFCD00006300 InChI Key: GCSHUYKULREZSJ-UHFFFAOYSA-N Synonym: 2-benzoylpyridine,phenyl pyridin-2-yl methanone,phenyl 2-pyridyl ketone,methanone, phenyl-2-pyridinyl,pyridine, 2-benzoyl,2-pyridyl phenyl ketone,ketone, phenyl 2-pyridyl,phenyl 2-pyridinyl methanone,phenyl-a-pyridylketone,phenyl 2-pyridyl methanone PubChem CID: 7038 IUPAC Name: phenyl(pyridin-2-yl)methanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC=N2
| PubChem CID | 7038 |
|---|---|
| CAS | 91-02-1 |
| Molecular Weight (g/mol) | 183.21 |
| MDL Number | MFCD00006300 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=CC=N2 |
| Synonym | 2-benzoylpyridine,phenyl pyridin-2-yl methanone,phenyl 2-pyridyl ketone,methanone, phenyl-2-pyridinyl,pyridine, 2-benzoyl,2-pyridyl phenyl ketone,ketone, phenyl 2-pyridyl,phenyl 2-pyridinyl methanone,phenyl-a-pyridylketone,phenyl 2-pyridyl methanone |
| IUPAC Name | phenyl(pyridin-2-yl)methanone |
| InChI Key | GCSHUYKULREZSJ-UHFFFAOYSA-N |
| Molecular Formula | C12H9NO |
(R)-1,2-Butanediol 98.0+%, TCI America™
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CAS: 40348-66-1 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.12 MDL Number: MFCD09953765 InChI Key: BMRWNKZVCUKKSR-UHFFFAOYNA-N Synonym: (R)-1,2-Butylene Glycol, (R)-1,2-Dihydroxybutane PubChem CID: 641012 ChEBI: CHEBI:52685 IUPAC Name: butane-1,2-diol SMILES: CCC(O)CO
| PubChem CID | 641012 |
|---|---|
| CAS | 40348-66-1 |
| Molecular Weight (g/mol) | 90.12 |
| ChEBI | CHEBI:52685 |
| MDL Number | MFCD09953765 |
| SMILES | CCC(O)CO |
| Synonym | (R)-1,2-Butylene Glycol, (R)-1,2-Dihydroxybutane |
| IUPAC Name | butane-1,2-diol |
| InChI Key | BMRWNKZVCUKKSR-UHFFFAOYNA-N |
| Molecular Formula | C4H10O2 |
Bis(2-methoxyethyl) Phthalate 96.0+%, TCI America™
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CAS: 117-82-8 Molecular Formula: C14H18O6 Molecular Weight (g/mol): 282.29 MDL Number: MFCD00042842 InChI Key: HSUIVCLOAAJSRE-UHFFFAOYSA-N Synonym: bis 2-methoxyethyl phthalate,kesscoflex mcp,2-methoxyethyl phthalate,dmep,bis methoxyethyl phthalate,di 2-methoxyethyl phthalate,kodaflex dmep,methyl glycol phthalate,dimethoxyethyl phthalate,dimethylglycol phthalate PubChem CID: 8344 IUPAC Name: 1,2-bis(2-methoxyethyl) benzene-1,2-dicarboxylate SMILES: COCCOC(=O)C1=CC=CC=C1C(=O)OCCOC
| PubChem CID | 8344 |
|---|---|
| CAS | 117-82-8 |
| Molecular Weight (g/mol) | 282.29 |
| MDL Number | MFCD00042842 |
| SMILES | COCCOC(=O)C1=CC=CC=C1C(=O)OCCOC |
| Synonym | bis 2-methoxyethyl phthalate,kesscoflex mcp,2-methoxyethyl phthalate,dmep,bis methoxyethyl phthalate,di 2-methoxyethyl phthalate,kodaflex dmep,methyl glycol phthalate,dimethoxyethyl phthalate,dimethylglycol phthalate |
| IUPAC Name | 1,2-bis(2-methoxyethyl) benzene-1,2-dicarboxylate |
| InChI Key | HSUIVCLOAAJSRE-UHFFFAOYSA-N |
| Molecular Formula | C14H18O6 |
2,5-Dihydroxybenzaldehyde 98.0+%, TCI America™
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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 |
Hexachloroacetone 98.0+%, TCI America™
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CAS: 116-16-5 Molecular Formula: C3Cl6O Molecular Weight (g/mol): 264.73 MDL Number: MFCD00000796 InChI Key: DOJXGHGHTWFZHK-UHFFFAOYSA-N Synonym: hexachloroacetone,hexachloro-2-propanone,perchloroacetone,hexachloropropanone,kureha hca,hca weedkiller,perchloro-2-propanone,bis trichloromethyl ketone,acetone, hexachloro,2-propanone, hexachloro PubChem CID: 8303 ChEBI: CHEBI:82243 IUPAC Name: hexachloropropan-2-one SMILES: ClC(Cl)(Cl)C(=O)C(Cl)(Cl)Cl
| PubChem CID | 8303 |
|---|---|
| CAS | 116-16-5 |
| Molecular Weight (g/mol) | 264.73 |
| ChEBI | CHEBI:82243 |
| MDL Number | MFCD00000796 |
| SMILES | ClC(Cl)(Cl)C(=O)C(Cl)(Cl)Cl |
| Synonym | hexachloroacetone,hexachloro-2-propanone,perchloroacetone,hexachloropropanone,kureha hca,hca weedkiller,perchloro-2-propanone,bis trichloromethyl ketone,acetone, hexachloro,2-propanone, hexachloro |
| IUPAC Name | hexachloropropan-2-one |
| InChI Key | DOJXGHGHTWFZHK-UHFFFAOYSA-N |
| Molecular Formula | C3Cl6O |