Introduction：Basic information about CAS 93-91-4|1-Phenylbutane-1,3-dione, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1-Phenylbutane-1,3-dione |
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| CAS Number | 93-91-4 | Molecular Weight | 162.19 |
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| Density | 1.1±0.1 g/cm3 | Boiling Point | 262.2±13.0 °C at 760 mmHg |
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| Molecular Formula | C10H10O2 | Melting Point | 54-56 °C(lit.) |
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| MSDS | ChineseUSA | Flash Point | 96.9±16.8 °C |
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| Symbol |
GHS07 | Signal Word | Warning |
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Names
| Name | 1-Phenyl-1,3-butanedione |
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| Synonym | More Synonyms |
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1-Phenylbutane-1,3-dione BiologicalActivity
| Description | 1-Phenylbutane-1,3-dione is a biochemical reagent that can be used as a biological material or organic compound for life science related research. |
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| Related Catalog | Research Areas >>Others |
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| In Vitro | 苯甲酰丙酮具有抗菌活性。 |
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Chemical & Physical Properties
| Density | 1.1±0.1 g/cm3 |
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| Boiling Point | 262.2±13.0 °C at 760 mmHg |
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| Melting Point | 54-56 °C(lit.) |
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| Molecular Formula | C10H10O2 |
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| Molecular Weight | 162.19 |
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| Flash Point | 96.9±16.8 °C |
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| Exact Mass | 162.068085 |
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| PSA | 34.14000 |
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| LogP | 2.52 |
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| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
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| Index of Refraction | 1.515 |
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| InChIKey | CVBUKMMMRLOKQR-UHFFFAOYSA-N |
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| SMILES | CC(=O)CC(=O)c1ccccc1 |
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| Water Solubility | insoluble |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- EK3540200
- CHEMICAL NAME :
- 1,3-Butanedione, 1-phenyl-
- CAS REGISTRY NUMBER :
- 93-91-4
- BEILSTEIN REFERENCE NO. :
- 0742413
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C10-H10-O2
- MOLECULAR WEIGHT :
- 162.20
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD - Lethal dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NCNSA6 National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. (Washington, DC) Volume(issue)/page/year: 5,28,1953
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 600 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- BCPCA6 Biochemical Pharmacology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1958- Volume(issue)/page/year: 14,1325,1965
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Safety Information
| Symbol |
GHS07 |
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| Signal Word | Warning |
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| Hazard Statements | H302-H315-H319-H335 |
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| Precautionary Statements | P261-P305 + P351 + P338 |
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| Personal Protective Equipment | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
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| Hazard Codes | Xn |
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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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| RTECS | EK3540200 |
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| HS Code | 29143900 |
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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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Articles17
More Articles
| Synthesis, Characterization and Biological Studies of Metal(II) Complexes of (3E)-3-[(2-{(E)-[1-(2,4-Dihydroxyphenyl) ethylidene]amino}ethyl)imino]-1-phenylbutan-1-one Schiff Base. Molecules 20 , 9788-802, (2015) Co(II), Ni(II), Zn(II) and Cu(II) complexes of (3E)-3-[(2-{(E)-[1-(2,4-dihydroxyphenyl)ethylidene]amino}ethyl)imino]-1-phenylbutan-1-one (DEPH2) derived from ethylenediamine, 2',4'-dihydroxyacetopheno... | |
| Potential anticonvulsants IV: Condensation of isatin with benzoylacetone and isopropyl methyl ketone. J. Pharm. Sci. 71(9) , 1052-4, (1982)
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| The sensitive determination of nucleic acids using fluorescence enhancement of Eu3+-benzoylacetone-cetyltrimethylammonium bromide-nucleic acid system. J. Fluoresc. 15(5) , 655-60, (2005) A new quantitative method for micro amounts of nucleic acids in aqueous solution is proposed using Eu3+-benzoylacetone (BA) complex as fluorescent probe in the presence of cetyltrimethyl-ammonium brom... | |
Synonyms
| Benzoylacetone |
| EINECS 202-286-4 |
| benzoyl acetone |
| 1-Phenylbutane-1,3-dione |
| 1-Phenyl-1,3-butanedion |
| 1-Phenyl-1,3-butanedione |
| α-Acetylacetophenone |
| 1,3-Butanedione, 1-phenyl- |
| MFCD00008786 |
