2-AMINO-1-(4-FLUORO-3-(TRIFLUOROMETHYL)PHENYL)ETHANONE 4-METHYLBENZENESULFONATE

CAS No.
1082951-17-4
CCD No.
CCD03648770
Formula
C9 H7 F4 N O . C7 H8 O3 S
MolWeight
393.355

Basic Information

Product Name: 2-AMINO-1-(4-FLUORO-3-(TRIFLUOROMETHYL)PHENYL)ETHANONE 4-METHYLBENZENESULFONATE
CAS: 1082951-17-4
English Synonyms: 2-AMINO-1-[4-FLUORO-3-(TRIFLUOROMETHYL)PHENYL]ETHANONE P-TOLUENESULFONATE SALT ; 2-AMINO-1-(4-FLUORO-3-(TRIFLUOROMETHYL)PHENYL)ETHANONE 4-METHYLBENZENESULFONATE
MDL Number.: MFCD17392808
H bond acceptor: 2
H bond donor: 1
Smile: Cc1ccc(cc1)S(=O)(=O)O.c1cc(c(cc1C(=O)CN)C(F)(F)F)F
InChi: InChI=1S/C9H7F4NO.C7H8O3S/c10-7-2-1-5(8(15)4-14)3-6(7)9(11,12)13;1-6-2-4-7(5-3-6)11(8,9)10/h1-3H,4,14H2;2-5H,1H3,(H,8,9,10)
InChiKey: InChIKey=JXCIEKVLIVDZJH-UHFFFAOYSA-N

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