Introduction：Basic information about CAS 6781-42-6|1,3-diacetylbenzene, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1,3-diacetylbenzene |
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| CAS Number | 6781-42-6 | Molecular Weight | 162.185 |
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| Density | 1.1±0.1 g/cm3 | Boiling Point | 280.3±0.0 °C at 760 mmHg |
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| Molecular Formula | C10H10O2 | Melting Point | 28-32 °C(lit.) |
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| MSDS | ChineseUSA | Flash Point | 108.5±19.6 °C |
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Names
| Name | 1,3-Diacetylbenzene |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.1±0.1 g/cm3 |
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| Boiling Point | 280.3±0.0 °C at 760 mmHg |
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| Melting Point | 28-32 °C(lit.) |
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| Molecular Formula | C10H10O2 |
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| Molecular Weight | 162.185 |
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| Flash Point | 108.5±19.6 °C |
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| Exact Mass | 162.068085 |
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| PSA | 34.14000 |
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| LogP | 1.43 |
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| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
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| Index of Refraction | 1.519 |
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| InChIKey | VCHOFVSNWYPAEF-UHFFFAOYSA-N |
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| SMILES | CC(=O)c1cccc(C(C)=O)c1 |
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| Storage condition | 2-8°C |
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Safety Information
| Personal Protective Equipment | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
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| Hazard Codes | Xi |
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| Safety Phrases | S22-S24/25 |
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| RIDADR | NONH for all modes of transport |
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| WGK Germany | 3 |
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| HS Code | 2914399090 |
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Customs
| HS Code | 2914399090 |
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| 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% |
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Articles2
More Articles
| Amino acid and protein targets of 1,2-diacetylbenzene, a potent aromatic gamma-diketone that induces proximal neurofilamentous axonopathy. Toxicol. Appl. Pharmacol. 183(1) , 55-65, (2002) The gamma-diketone analogs 1,2-diacetylbenzene (1,2-DAB) and 2,5-hexanedione (2,5-HD), but not the delta-diketone 1,3-diacetylbenzene (1,3-DAB) or the beta-diketone 2,4-hexanedione, induce neuropathol... | |
| Geometrically and conformationally restrained cinnamoyl compounds as inhibitors of HIV-1 integrase: synthesis, biological evaluation, and molecular modeling. J. Med. Chem. 41(21) , 3948-60, (1998) Various cinnammoyl-based structures were synthesized and tested in enzyme assays as inhibitors of the HIV-1 integrase (IN). The majority of compounds were designed as geometrically or conformationally... | |
Synonyms
| EINECS 229-842-9 |
| 1,3-diacetylbenzene |
| 1-(3-acetylphenyl)ethanone |
| Ethanone, 1,1'-(1,3-phenylene)bis- |
| 1,1'-benzene-1,3-diyldiethanone |
| MFCD00008740 |
| 1,1'-(1,3-Phenylene)diethanone |
