1350636-92-8

Name S-((1R,2R,4R)-2-hydroxy-4-(2,2,2-trifluoroacetamido)cyclohexyl)benzothioate
CAS 1350636-92-8
Molecular Formula C15H16F3NO3S
Molecular Weight 347.35
MOL File 1350636-92-8.mol
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Chemical Properties

Boiling point  473.6±45.0 °C(Predicted)
density  1.39±0.1 g/cm3(Predicted)
pka 10.39±0.60(Predicted)
InChI InChI=1S/C15H16F3NO3S/c16-15(17,18)14(22)19-10-6-7-12(11(20)8-10)23-13(21)9-4-2-1-3-5-9/h1-5,10-12,20H,6-8H2,(H,19,22)/t10-,11-,12-/m1/s1
InChIKey QBWQBQSXEUQQND-IJLUTSLNSA-N
SMILES C1(C(S[C@@H]2CC[C@@H](NC(C(F)(F)F)=O)C[C@H]2O)=O)=CC=CC=C1

Safety Data

REACH Registrations Active

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