187324-63-6

Name (1R,2S)-2-[N-BENZYL-N-(MESITYLENESULFONYL)AMINO]-1-PHENYL-1-PROPANOL
CAS 187324-63-6
Molecular Formula C25H29NO3S
MDL Number MFCD02093446
Molecular Weight 423.57
MOL File 187324-63-6.mol
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Chemical Properties

Melting point  130.0 to 134.0 °C
Boiling point  601.9±65.0 °C(Predicted)
density  1.186±0.06 g/cm3(Predicted)
refractive index  -7 ° (C=2, CHCl3)
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
form  powder to crystal
pka 13.49±0.20(Predicted)
color  White to Almost white
InChI 1S/C25H29NO3S/c1-18-15-19(2)25(20(3)16-18)30(28,29)26(17-22-11-7-5-8-12-22)21(4)24(27)23-13-9-6-10-14-23/h5-16,21,24,27H,17H2,1-4H3/t21-,24-/m0/s1
InChIKey ZPERKXJNXPLVAC-URXFXBBRSA-N
SMILES [S](=O)(=O)(N([C@H]([C@H](O)c3ccccc3)C)Cc2ccccc2)c1c(cc(cc1C)C)C

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338
WGK Germany  WGK 3
HS Code  2935.90.9500
Storage Class 11 - Combustible Solids

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