2,5-己酮可可碱

pro_cas
117570-53-3
pro_cdbregno
CCD00177983
pro_formula
C17 H14 O4
pro_molWeight
282.294

basic_info

Product_Name: 2,5-己酮可可碱
CAS: 117570-53-3
中文同义词: 2,5-己酮可可碱 ; 5,6-二甲基呫吨酮-4-乙酸
EnglishSynonyms: (5,6-DIMETHYL-9-OXO-XANTHEN)-4-ACETIC ACID ; VADIMEZAN ; 5,6-MEXAA ; 5,6-DIMETHYL-9-OXO-9H-XANTHENE-4-ACETIC ACID ; ASA404 ; 5,6-DIMETHYLXANTHEONONE-4-ACETIC ACID ; DMXAA ; 5,6-DIMETHYLXANTHENONE-4-ACETIC ACID ; DMXAA (VADIMEZAN) ; (5,6-DIMETHYL-9-OXO-9H-XANTHEN-4-YL)-ACETIC ACID
pro_mdlNumber: MFCD00870555
pro_acceptors: 4
pro_donors: 1
pro_smile: Cc1ccc2c(=O)c3cccc(c3oc2c1C)CC(=O)O
InChi: InChI=1S/C17H14O4/c1-9-6-7-13-15(20)12-5-3-4-11(8-14(18)19)17(12)21-16(13)10(9)2/h3-7H,8H2,1-2H3,(H,18,19)
InChiKey: InChIKey=XGOYIMQSIKSOBS-UHFFFAOYSA-N

property

secure_info

secure_symbol: GHS07 GHS07 GHS09 GHS09
secure_signal_word: Warning
secure_risk_stmt: H302-H400
secure_cautionary_stmt: P273
secure_damage_code: Xn,N
secure_risk_disclosure_stmt: R:22-50/53
secure_security_stmt: S:60-61
secure_wgk_germany: 3

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