CAS Number454-89-7
Synonymsm-(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; m-trifluorotolualdehyde; 3-(trifluoromethyl)-benzaldehyd; M-TRIFLUOROMETHYLBENZALDEHYDE
Molecular FormulaCF3C6H4CHO
Molecular Weight174.12
Purity97%
Density1.3±0.1 g/cm3
Boiling Point83-86 °C/30 mmHg (lit.)
Appearanceliquid
EINECS207-228-1
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 454-89-7 |
| Catalog No. | 2A-9021970 |
| Chinese Name | 间三氟甲基苯甲醛 |
| 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; m-trifluorotolualdehyde; 3-(trifluoromethyl)-benzaldehyd; M-TRIFLUOROMETHYLBENZALDEHYDE |
| Molecular Formula | CF3C6H4CHO |
| Molecular Weight | 174.12 |
| Purity | 97 |
| Density | 1.3±0.1 g/cm3 |
| Boiling Point | 83-86 °C/30 mmHg (lit.) |
| Appearance | liquid |
| Storage Condition | Store in a sealed container in a ventilated and dr |
| Application | 3-(Trifluoromethyl)benzaldehyde is an active compound that can be used in the synthesis of 2,3-di- and 2,2,3-trisubstituted-3-methoxycarbonyl-γ-butyrolactone. 2,3-di- and 2,2,3-trisubstituted-3-methox |
| EINECS | 207-228-1 |
| HTC | 2913000090 |
| PubChem ID | 24851803 |
| MDL Number | MFCD00003373 |
| SMILES | [H]C(=O)c1cccc(c1)C(F)(F)F |
| InChI | 1S/C8H5F3O/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-5H |
| InChI Key | NMTUHPSKJJYGML-UHFFFAOYSA-N |
| Beilstein/REAXYS | 2327537 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | Transport |
| MSDS | msds/21970_1_454_89_7.pdf |
| Bioactivity | 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]. Related Catalog Research Areas >> Cancer Signaling Pathways >> Others >> Others 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. Chemical & Physical Properties Density 1.3±0.1 g/cm3 Boiling Point 176.3±35.0 °C at 760 mmHg Molecular Formula C8H5F3O Molecular Weight 174.120 Flash Point 68.3±0.0 °C Exact Mass 174.029251 PSA 17.07000 LogP 2.47 Vapour Pressure 1.1±0.3 mmHg at 25°C Index of Refraction 1.476 InChIKey NMTUHPSKJJYGML-UHFFFAOYSA-N SMILES O=Cc1cccc(C(F)(F)F)c1 |
| Use of | 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]. Properties Name 3-(Trifluoromethyl)benzaldehyde Synonym More Synonyms 3-(Trifluoromethyl)benzaldehyde Biological Activity 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]. Related Catalog Research Areas >> Cancer Signaling Pathways >> Others >> Others 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. Chemical & Physical Properties Molecular Formula C8H5F3O Exact Mass 174.029251 PSA 17.07000 Index of Refraction 1.476 InChIKey NMTUHPSKJJYGML-UHFFFAOYSA-N |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 5.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Purity: 0.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN number European Land Transport Danger Regulations: 3082 International Maritime Danger Regulations: 3082 International Air Transport Danger Regulations: 3082 14.2 Names specified by the United Nations (UN) European land transport hazard regulations: ENVIRONMENTALLY HAZARDOUS SUBSTANCE, LIQUID, N.O.S. (α,α,α-Trifluoro-3- tolualdehyde) IMDG: ENVIRONMENTALLY HAZARDOUS SUBSTANCE, LIQUID, N.O.S. (α,α,α-Trifluoro-3- tolualdehyde) International air transport hazard regulations: Environmentally hazardous substance, liquid, n.o.s. (α,α,α-Trifluoro-3-tolualdehyde) 14.3 Transport hazard categories European land transport Dangerous Regulations: 9 International sea transport Dangerous Regulations: 9 International air transport Dangerous Regulations: 9 14.4 Package group European Land Transport Danger Regulations: III International Maritime Transport Danger Regulations: III International Air Transport Danger Regulations: III 14.5 Environmental hazards European Land Transport Dangerous Regulations: Yes International Maritime Transport Dangerous Regulations Maritime Pollutants: Yes International Air Transport Dangerous Regulations: Yes 14.6 Special precautions for users further information Dangerous goods are individually packaged, with liquids exceeding 5 liters or solids exceeding 5 kilograms. The outer packaging of each independent package and the combined independent inner package must have EHS on it. Identification (according to European ADR Regulation 2.2.9.1.10, IMDG Regulation 2.10.3), |
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