61718-80-7
中文名稱
5-甲氧基-1-[4-(三氟甲基)苯基]-1-戊酮
英文名稱
5-Methoxy-1-[4-(trifluoromethyl)phenyl]-1-pentanone
CAS
61718-80-7
分子式
C13H15F3O2
MDL 編號
MFCD06658173
分子量
260.25
MOL 文件
61718-80-7.mol
更新日期
2026/07/16 12:23:07
61718-80-7 結構式
基本信息
中文別名
5-甲氧基-1-[4-(三氟甲基)苯基]-1-戊酮1-對三氟甲苯基-5-甲氧基-戊酮
英文別名
(4-METHOXYBUTYL)(4-TRIFLUOROMETHYLPHENYL)METHANONE5-METHOXY-1-[4-(TRIFLUOROMETHYL)PHENYL]-1-PENTANONE
(E)-5-METHOXY-1-[4-(TRIFLUOROMETHYL)PHENYL]-1-PENTANONE
5-Methoxy-1-(4-Trifluoromethylphenyl)Pentanone
5-Methoxy-1-[4-(Trifluoromethy
6-(1-bromoethane)-4-chloro-5-fluoro pyrimidine (intermediate of voriconazole)
1-Pentanone, 5-methoxy-1-[4-(trifluoromethyl)phenyl]-
5-Methoxy-4''-(trifluoromethyl)-valerophenone
5-METHOXY-1-[4-(TRIFLUOROMETHYL)PHENYL]-1-PENTANONE (MECO) (FLUVOXAMINE INTERMEDIATE)
5-methoxy-1-[4-(trifluoromethyl)phenyl]-1-pentanone(MECO)
Fluvoxketone
所屬類別
原料藥：抗抑郁、躁狂藥物理化學性質
熔點50-52°C
沸點318.7±42.0 °C(Predicted)
密度1.147±0.06 g/cm3(Predicted)
蒸氣壓0Pa at 20℃
儲存條件Sealed in dry,Room Temperature
溶解度Chloroform (Slightly), Methanol (Slightly)
形態(tài)neat
外觀White to off-white Solid
水溶解性74.36mg/L at 20℃
主要應用pharmaceutical
pharmaceutical small molecule
pharmaceutical small molecule
InChIInChI=1S/C13H15F3O2/c1-18-9-3-2-4-12(17)10-5-7-11(8-6-10)13(14,15)16/h5-8H,2-4,9H2,1H3
InChIKeyVYKSRLDHXQURKA-UHFFFAOYSA-N
SMILESC(C1=CC=C(C(F)(F)F)C=C1)(=O)CCCCOC
LogP3.3
安全數據
警示詞警告
危險性描述H411
防范說明P273-P391-P501
危險品運輸編號UN 3077 9 / PGIII
WGK GermanyWGK 2
REACH 注冊登記Active
海關編碼2914500090
存儲類別13 - Non Combustible Solids
危險性類別Aquatic Chronic 2