Ethanone,1-(2,3,5,6-tetramethylphenyl)
Ethanone,1-(2,3,5,6-tetramethylphenyl) structure
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Common Name | Ethanone,1-(2,3,5,6-tetramethylphenyl) | ||
|---|---|---|---|---|
| CAS Number | 2142-79-2 | Molecular Weight | 176.25500 | |
| Density | 0.947g/cm3 | Boiling Point | 281.4ºC at 760mmHg | |
| Molecular Formula | C12H16O | Melting Point | 74-75ºC | |
| MSDS | N/A | Flash Point | 115.5ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 1-(2,3,5,6-tetramethylphenyl)ethanone |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 0.947g/cm3 |
|---|---|
| Boiling Point | 281.4ºC at 760mmHg |
| Melting Point | 74-75ºC |
| Molecular Formula | C12H16O |
| Molecular Weight | 176.25500 |
| Flash Point | 115.5ºC |
| Exact Mass | 176.12000 |
| PSA | 17.07000 |
| LogP | 3.12280 |
| Vapour Pressure | 0.00358mmHg at 25°C |
| Index of Refraction | 1.509 |
| InChIKey | JCNRSGPJXDRATR-UHFFFAOYSA-N |
| SMILES | CC(=O)c1c(C)c(C)cc(C)c1C |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|---|
| Safety Phrases | S22-S24/25 |
| HS Code | 2914399090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 8 | |
|---|---|
| DownStream 8 | |
CAS#:95-93-2
CAS#:75-36-5
CAS#:488-23-3
CAS#:108-24-7
CAS#:527-53-7
CAS#:15517-58-5
CAS#:95-63-6
CAS#:34764-71-1
CAS#:700-12-9
CAS#:15517-57-4
CAS#:1667-01-2
CAS#:527-35-5
CAS#:64853-55-0This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2914399090 |
|---|---|
| Summary | 2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: qHTS assay for inhibitors of human lactate dehydrogenase
Source: NCGC
Target: N/A
External Id: LDHA
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Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
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Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
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Name: Primary qHTS Assay for Foot and Mouth Disease Virus Antivirals against NCGC Sytravon ...
Source: NCGC
External Id: stopgo-p2-SytraCBC-dual-FF
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Name: Primary qHTS Assay for Foot and Mouth Disease Virus Antivirals against NCGC Sytravon ...
Source: NCGC
External Id: stopgo-p2-SytraCBC-dual-Ren
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Methyl duryl ketone |
| 1-acetyl-2,3,5,6-tetramethylbenzene |
| 1-(2,3,5,6-TETRAMETHYL-PHENYL)-ETHANONE |
| acetyldurene |
| 2,3,5,6-tetrametilacetofenone |
| MFCD00014987 |
| acetodurene |
| 2,3,5,6-Tetramethylacetophenone |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the safety information for 1-(2,3,5,6-tetramethylphenyl)ethanone? |
| A: Safety information for 1-(2,3,5,6-tetramethylphenyl)ethanone: S22-S24/25. |
| Q: What is the molecular weight of 1-(2,3,5,6-tetramethylphenyl)ethanone? |
| A: Molecular weight of 1-(2,3,5,6-tetramethylphenyl)ethanone is 176.25500. |
| Q: What is the CAS number of 1-(2,3,5,6-tetramethylphenyl)ethanone? |
| A: CAS number of 1-(2,3,5,6-tetramethylphenyl)ethanone is 2142-79-2. |
| Q: What is the polar surface area (PSA) of 1-(2,3,5,6-tetramethylphenyl)ethanone? |
| A: Polar surface area (PSA) of 1-(2,3,5,6-tetramethylphenyl)ethanone is 17.07000. |
| Q: What English synonyms does 1-(2,3,5,6-tetramethylphenyl)ethanone have? |
| A: English synonyms of 1-(2,3,5,6-tetramethylphenyl)ethanone: Methyl duryl ketone, 1-acetyl-2,3,5,6-tetramethylbenzene, 1-(2,3,5,6-TETRAMETHYL-PHENYL)-ETHANONE, acetyldurene, 2,3,5,6-tetrametilacetofenone, MFCD00014987, acetodurene, 2,3,5,6-Tetramethylacetophenone. |
| Q: What is the English name of 1-(2,3,5,6-tetramethylphenyl)ethanone? |
| A: The English name of 1-(2,3,5,6-tetramethylphenyl)ethanone is 1-(2,3,5,6-tetramethylphenyl)ethanone. |
| Q: What is the InChIKey of 1-(2,3,5,6-tetramethylphenyl)ethanone? |
| A: InChIKey of 1-(2,3,5,6-tetramethylphenyl)ethanone is JCNRSGPJXDRATR-UHFFFAOYSA-N. |
| Q: What are the downstream products of 1-(2,3,5,6-tetramethylphenyl)ethanone? |
| A: Related downstream products(CAS) of 1-(2,3,5,6-tetramethylphenyl)ethanone: 95-93-2;527-53-7;700-12-9;34764-71-1;15517-57-4;1667-01-2;527-35-5;64853-55-0. |
| Q: What are the upstream materials of 1-(2,3,5,6-tetramethylphenyl)ethanone? |
| A: Related upstream materials(CAS) of 1-(2,3,5,6-tetramethylphenyl)ethanone: 95-93-2;75-36-5;488-23-3;108-24-7;527-53-7;15517-58-5;95-63-6;34764-71-1. |
| Q: What is the SMILES notation of 1-(2,3,5,6-tetramethylphenyl)ethanone? |
| A: SMILES notation of 1-(2,3,5,6-tetramethylphenyl)ethanone is CC(=O)c1c(C)c(C)cc(C)c1C. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |