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30459-17-7

中文名稱 N-(ALPHA,ALPHA,ALPHA-三氟對(duì)甲苯)哌嗪
英文名稱 1-(4-TRIFLUOROMETHYLPHENYL)PIPERAZINE
CAS 30459-17-7
EINECS 編號(hào) 250-210-3
分子式 C11H13F3N2
MDL 編號(hào) MFCD00040765
分子量 230.23
MOL 文件 30459-17-7.mol
更新日期 2025/07/28 17:22:08
30459-17-7 結(jié)構(gòu)式 30459-17-7 結(jié)構(gòu)式

基本信息

中文別名
N-(ALPHA,ALPHA,ALPHA-三氟對(duì)甲苯)哌嗪
三氟甲基苯基哌嗪
1-(4-三氟甲基苯基)哌嗪
英文別名
1-(4-TRIFLUOROMETHYLPHENYL)PIPERAZINE
1-(4-TRIFLUOROMETHYL-PHENYL)-PIPERAZINE DIHYDROCHLORIDE
1-(ALPHA,ALPHA,ALPHA-TRIFLUORO-P-TOLYL)PIPERAZINE
4-PIPERAZINOBENZOTRIFLUORIDE
N-(4-TRIFLUOROMETHYLPHENYL)PIPERAZINE
N-(ALPHA,ALPHA,ALPHA-TRIFLUORO-P-TOLYL)PIPERAZINE
RARECHEM AH CK 0204
trifluoromethylphenylpiperazine
1-(4-Trifluormethylphenyl)-piperazine
1-(α,α,α-trifluoro-p-tolyl)piperazine
1-[4-(Trifluoromethyl)phenyl]piperazine 97%
1-[4-(Trifluoromethyl)phenyl]piperazine97%
1-(4-TRIFLUOROMETHYLPHENYL)PIPERAZINE PURUM 98+% (GC)
1-(4-TRIFLUOROMETHYLPHENYL)-PIPERAZINE >98%
1-(4-Trifluoromethyphenyl) piperazine
所屬類別
醫(yī)藥中間體:哌嗪類化合物

物理化學(xué)性質(zhì)

熔點(diǎn)88-92 °C
沸點(diǎn)309.1±42.0 °C(Predicted)
密度1.203
儲(chǔ)存條件RT, protect from light
溶解度溶于甲醇
酸度系數(shù)(pKa)8.79±0.10(Predicted)
形態(tài)Crystals
顏色無色至淡黃色
BRN523408
InChIKeyIBQMAPSJLHRQPE-UHFFFAOYSA-N
CAS 數(shù)據(jù)庫30459-17-7(CAS DataBase Reference)
存儲(chǔ)注意事項(xiàng)惰性氣體保護(hù);空氣敏感

安全數(shù)據(jù)

危險(xiǎn)性符號(hào)(GHS)GHS hazard pictograms
GHS07
警示詞警告
危險(xiǎn)性描述H315-H319-H335
危險(xiǎn)品標(biāo)志Xi,C
危險(xiǎn)類別碼R36/37/38
安全說明S26-S36
WGK Germany3
Hazard NoteCorrosive
海關(guān)編碼29339900

制備方法

方法1
哌嗪

110-85-0

對(duì)氯三氟甲苯

98-56-6

1-(4-三氟甲苯基)哌嗪

30459-17-7

實(shí)施例4:將4-氯三氟甲苯(18.5 g,100 mmol)和哌嗪(12.9 g,150 mmol)溶解于200 mL三正丁胺中,室溫下通入氮?dú)?5分鐘進(jìn)行脫氣。隨后加入無水叔丁醇鈉(13.5 g,140 mmol),繼續(xù)脫氣10分鐘。在另一容器中,將[2-(2,6-二甲氧基苯基)苯基]二環(huán)己基膦(41 mg,0.1 mmol)與(二亞芐基丙酮)鈀(20 mg,0.025 mmol)在氮?dú)獗Wo(hù)下于5 mL脫氣的四氫呋喃中攪拌30分鐘。之后,通過轉(zhuǎn)移針在室溫下將該催化劑溶液逐滴加入主反應(yīng)燒瓶中。滴加完畢后,將反應(yīng)體系加熱至內(nèi)溫110℃,維持反應(yīng)8小時(shí)。反應(yīng)完成后,冷卻至50℃,過濾除去沉淀的固體。濾液經(jīng)減壓濃縮后,用pH3的稀鹽酸進(jìn)行萃取。分離水相后,用氫氧化鈉溶液調(diào)節(jié)至pH10,析出白色固體,過濾并減壓干燥,得到N-(4-三氟甲基苯基)哌嗪22.1 g(96 mmol,收率96%)。產(chǎn)物純度通過定量質(zhì)子NMR測定,確認(rèn)>99%。

參考文獻(xiàn):

[1] Patent: US2005/250791, 2005, A1. Location in patent: Page/Page column 4

[2] Patent: KR101589584, 2016, B1. Location in patent: Paragraph 0098-0102

[3] Patent: US2005/250791, 2005, A1. Location in patent: Page/Page column 4

[4] Patent: US2005/250791, 2005, A1. Location in patent: Page/Page column 4

[5] Patent: US2005/250791, 2005, A1. Location in patent: Page/Page column 4

1-(4-三氟甲苯基)哌嗪價(jià)格(試劑級(jí))
報(bào)價(jià)日期產(chǎn)品編號(hào)產(chǎn)品名稱CAS號(hào)包裝價(jià)格
2025/05/2236712N-(a,a,a-三氟對(duì)甲苯)哌嗪(98%)
N-(alpha,alpha,alpha-Trifluoro-p-tolyl)piperazine, 98%, Thermo Scientific Chemicals
30459-17-71g873元
2025/05/2236712N-(a,a,a-三氟對(duì)甲苯)哌嗪(98%)
N-(alpha,alpha,alpha-Trifluoro-p-tolyl)piperazine, 98%, Thermo Scientific Chemicals
30459-17-75g3652元
2025/05/22T27411-(4-三氟甲苯基)哌嗪
1-(4-Trifluoromethylphenyl)piperazine
30459-17-75g580元
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