1350636-89-3

Name {(1R,2R,4R)-4-[(tert-butoxycarbonyl)-amino]-2-hydroxy-cyclohexyl} benzene-carbothioate
CAS 1350636-89-3
Molecular Formula C18H25NO4S
Molecular Weight 351.46
MOL File 1350636-89-3.mol
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Chemical Properties

Boiling point  501.4±50.0 °C(Predicted)
density  1.21±0.1 g/cm3(Predicted)
pka 11.89±0.60(Predicted)
InChI InChI=1S/C18H25NO4S/c1-18(2,3)23-17(22)19-13-9-10-15(14(20)11-13)24-16(21)12-7-5-4-6-8-12/h4-8,13-15,20H,9-11H2,1-3H3,(H,19,22)/t13-,14-,15-/m1/s1
InChIKey LHDLTHNHAQHWQB-RBSFLKMASA-N
SMILES C1(C(S[C@@H]2CC[C@@H](NC(OC(C)(C)C)=O)C[C@H]2O)=O)=CC=CC=C1

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