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Tefludazine
[CAS# 80680-06-4]

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Identification
Name Tefludazine
Synonyms 2-[4-[(1R,3S)-3-(4-Fluorophenyl)-6-(Trifluoromethyl)Indan-1-Yl]Piperazin-1-Yl]Ethanol; 2-[4-[(1R,3S)-3-(4-Fluorophenyl)-6-(Trifluoromethyl)-1-Indanyl]-1-Piperazinyl]Ethanol; Tefludazinum [Latin]
Molecular Structure CAS#: 80680-06-4, Tefludazine
Molecular Formula C22H24F4N2O
Molecular Weight 408.44
CAS Registry Number 80680-06-4
SMILES [C@@H]2(C3=C([C@H](C1=CC=C(C=C1)F)C2)C=CC(=C3)C(F)(F)F)N4CCN(CCO)CC4
InChI 1S/C22H24F4N2O/c23-17-4-1-15(2-5-17)19-14-21(28-9-7-27(8-10-28)11-12-29)20-13-16(22(24,25)26)3-6-18(19)20/h1-6,13,19,21,29H,7-12,14H2/t19-,21+/m0/s1
InChIKey JSBWGXQXCRYYTG-PZJWPPBQSA-N
Properties
Density 1.285g/cm3 (Cal.)
Boiling point 476.444°C at 760 mmHg (Cal.)
Flash point 241.945°C (Cal.)
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