Introduction：Basic information about CAS 454-89-7|3-(Trifluoromethyl)benzaldehyde, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-(Trifluoromethyl)benzaldehyde |
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| CAS Number | 454-89-7 | Molecular Weight | 174.120 |
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| Density | 1.3±0.1 g/cm3 | Boiling Point | 176.3±35.0 °C at 760 mmHg |
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| Molecular Formula | C8H5F3O | Melting Point | / |
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| MSDS | ChineseUSA | Flash Point | 68.3±0.0 °C |
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| Symbol |
GHS07, GHS09 | Signal Word | Warning |
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Names
| Name | 3-(Trifluoromethyl)benzaldehyde |
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| Synonym | More Synonyms |
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3-(Trifluoromethyl)benzaldehyde BiologicalActivity
| Description | 3-(Trifluoromethyl)benzaldehyde is an active compound, and can be used for the synthesis of 2,3-di- and 2,2,3-trisubstituted-3-methoxycarbonyl-γ-butyrolactones. 2,3-di- and 2,2,3-trisubstituted-3-methoxycarbonyl-γ-butyrolactones are potent antitumor agents[1]. |
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| Related Catalog | Research Areas >>CancerSignaling Pathways >>Others >>Others |
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| References | [1]. Le Floch C, et al. Synthesis of 2,3-di- and 2,2,3-trisubstituted-3-methoxycarbonyl-γ-butyrolactones as potent antitumor agents. Eur J Med Chem. 2015 Jan 7;89:654-70. |
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Chemical & Physical Properties
| Density | 1.3±0.1 g/cm3 |
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| Boiling Point | 176.3±35.0 °C at 760 mmHg |
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| Molecular Formula | C8H5F3O |
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| Molecular Weight | 174.120 |
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| Flash Point | 68.3±0.0 °C |
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| Exact Mass | 174.029251 |
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| PSA | 17.07000 |
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| LogP | 2.47 |
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| Vapour Pressure | 1.1±0.3 mmHg at 25°C |
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| Index of Refraction | 1.476 |
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| InChIKey | NMTUHPSKJJYGML-UHFFFAOYSA-N |
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| SMILES | O=Cc1cccc(C(F)(F)F)c1 |
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Safety Information
| Symbol |
GHS07, GHS09 |
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| Signal Word | Warning |
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| Hazard Statements | H315-H319-H335-H400 |
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| Precautionary Statements | P261-P273-P305 + P351 + P338 |
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| Personal Protective Equipment | Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
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| Hazard Codes | Xi:Irritant |
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| Risk Phrases | R36/37/38 |
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| Safety Phrases | S26-S36 |
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| RIDADR | UN3082 - class 9 - PG 3 - DOT NA1993 - Environmentally hazardous substances, liquid, n.o.s. HI: all (not BR) |
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| WGK Germany | 3 |
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| HS Code | 2913000090 |
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Customs
| HS Code | 2913000090 |
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| Summary | HS: 2913000090 halogenated, sulphonated, nitrated or nitrosated derivatives of products of heading 2912 Educational tariff:17.0% Tax rebate rate:9.0% Regulatory conditions:none Most favored nation tariff:5.5% General tariff:30.0% |
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Articles1
More Articles
| Synthesis of fluorinated materials catalyzed by proline or antibody 38C2 in ionic liquid. Kitazume T, et al. J. Fluor. Chem. 121(2) , 205-12, (2003)
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Synonyms
| m-(Trifluoromethyl)benzaldehyde |
| α,α,α-Trifluoro-m-tolualdehyde |
| 3-TRIFLUORMETHYLBENZALDEHYDE |
| 3-(Trifluoromethyl)benzaldehyde |
| 3-TRIFLUOROMETHYLBENZYLDEHYDE |
| m-Trifuoromethylbenzaldehyde |
| 3-(trifluoromethyl)-benzaldehyde |
| 3-trifluoromethylbenzaldehye |
| 3-trifluromethyl-benzaldehyde |
| MFCD00003373 |
| MTF-BAD |
| VHR CXFFF |
| EINECS 207-228-1 |
| A,A,A-TRIFLUORO-M-TOLUALDEHYDE |
| A,A,A-TRIFLUORO-3-TOLUALDEHYDE |
| Benzaldehyde, 3-(trifluoromethyl)- |
| m-trifluorotolualdehyde |
| 3-(trifluoromethyl)-benzaldehyd |
| M-TRIFLUOROMETHYLBENZALDEHYDE |
