English name: Orlistat
CAS number: 96829-58-2
Molecular formula: C29H53NO5
Molecular weight: 495.73
EINECS number: 639-755-1
MDL No. : MFCD05662360
Stats
Melting point <50 °C
Specific rotation D20-32.0 ° (c = 1 in chloroform)
Boiling point 615.9±30.0 °C(Predicted)
Density 0.976± 0.06g /cm3(Predicted)
Storage conditions 2-8°C
Solubility DMSO: 19 mg/mL
Form solid
Acidity coefficient (pKa)14.59±0.23(Predicted)
Color white
Merck14, 6869
Stable for 1 year from date of purchase as supplied. Solutions in DMSO or ethanol may be stored at -20° for up to 1 week.
InChIKeyAHLBNYSZXLDEJQ-FWEHEUNISA-N
SMILESC(O[C@H](C[C@H]1[C@H](CCCCCC)C(=O)O1)CCCCCCCCCCC)(=O)[C@H](CC(C)C)NC=O
Safety information
GHS hazard pictograms GHS Hazard pictograms
GHS07
Warning word
Hazard Description H302-H412
Preventive instructions P273
WGK Germany3
RTECS number OH3167600
Customs Code 29322090


