212555-28-7

Name (1S,2S)-(-)-N,N-DI-P-TOSYL-1,2-CYCLOHEXANEDIAMINE
CAS 212555-28-7
Molecular Formula C20H26N2O4S2
MDL Number MFCD01863518
Molecular Weight 422.56
MOL File 212555-28-7.mol

Chemical Properties

Melting point  170-173 °C(lit.)
Boiling point  591.4±60.0 °C(Predicted)
density  1.33±0.1 g/cm3(Predicted)
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
pka 11.02±0.40(Predicted)
Appearance White to off-white Solid
Optical Rotation [α]22/D 3°, c = 2.33 in pyridine
InChI 1S/C20H26N2O4S2/c1-15-7-11-17(12-8-15)27(23,24)21-19-5-3-4-6-20(19)22-28(25,26)18-13-9-16(2)10-14-18/h7-14,19-22H,3-6H2,1-2H3/t19-,20-/m0/s1
InChIKey FIAAGQKYVFEMGC-PMACEKPBSA-N
SMILES Cc1ccc(cc1)S(=O)(=O)N[C@H]2CCCC[C@@H]2NS(=O)(=O)c3ccc(C)cc3

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements 
Safety Statements 
WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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