(S)-(+)-1-茚醇

pro_cas
25501-32-0 ;851477-20-8
pro_cdbregno
CCD00818304
pro_formula
C17 H21 F6 N3 S
pro_molWeight
413.428

basic_info

Product_Name: (S)-(+)-1-茚醇
CAS: 25501-32-0 ;851477-20-8
中文同义词: (S)-(+)-1-茚醇 ; 1-[3,5-二(三氟甲基)苯基]-3-[(1S,2S)-(+)-2-(二甲氨基)环己基]硫脲(S,S-TUC)
EnglishSynonyms: 1-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]-3-[(1S,2S)-(+)-2-(DIMETHYLAMINO)CYCLOHEXYL]THIOUREA ; 1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-3-((1S,2S)-2-(DIMETHYLAMINO)CYCLOHEXYL)THIOUREA ; S,S-TUC
pro_mdlNumber: MFCD09834840
pro_acceptors: 3
pro_donors: 2
pro_smile: CN(C)[C@H]1CCCC[C@@H]1NC(=S)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F
InChi: InChI=1S/C17H21F6N3S/c1-26(2)14-6-4-3-5-13(14)25-15(27)24-12-8-10(16(18,19)20)7-11(9-12)17(21,22)23/h7-9,13-14H,3-6H2,1-2H3,(H2,24,25,27)/t13-,14-/m0/s1
InChiKey: InChIKey=NQRCAVZHOLYEBJ-KBPBESRZSA-N

property

MeltingPoint: 87-88 DEG C
Comments: 01 SOLD FOR RESEARCH PURPOSES ONLY
02 PATENTS PCT APPLICATION NO: JP2004009350 (PUBLICATION WO2005000803) US APPLICATION 10/562,579
03 EPC APPLICATION 04746819.4
SPECIFIC ROTATION: +42 DEG (C 1.16, CHCL3)
WHITE POWDER

secure_info

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