English name: LGD-4033
CAS number: 1165910-22-4
Molecular formula: C14H12F6N2O
Molecular weight: 338.25
EINECS number: 1806241-263-5
MDL No. : MFCD27923016
Stats
Melting point 108-111 °C
Boiling point 439.9±45.0 °C(Predicted)
Density 1.45± 0.1g /cm3(Predicted)
Storage conditions are Hygroscopic, -20°C Freezer, Under inert atmosphere
Solubility Acetone (Slightly), Chloroform (Slightly, Heated), Methanol (Slightly)
The shape is A crystalline solid
Acidity coefficient (pKa)12.06±0.20(Predicted)
The color is White to Pale Beige
Stability Hygroscopic
InChIInChI = 1 s/C14H12F6N2O/c15-13 (16 or 17), 10-6-9, 4-3-8 (10) 7-21) 4-3-8-2-11 (22) (23), 14 (18th and 19th) 20 /,6,11 h3-4-12, 10 H, 1 to 2, 5 H2 / t1 1-,12-/m1/s1
InChIKeyOPSIVAKKLQRWKC-VXGBXAGGSA-N
SMILESC(#N)C1=CC=C(N2CCC[C@@H]2[C@@H](O)C(F)(F)F)C=C1C(F)(F)F
Safety information
GHS hazard pictograms GHS Hazard pictograms
GHS07
Warning word
Hazard Description H302-H315-H319-H335
Precautions P261-P264-P270-P271-P280-P301+P312-P330-P302+P352-P321-P304+P340-P305+P351+P338-P332+P313-P362+P364-P337+P313-P403+P 233-P405-P501


