Identification Chemical Properties Safety Data Hazard Information Spectrum Detail Supplier Related Products

845533-86-0

Name Bedaquiline (fuMarate)
CAS 845533-86-0
Molecular Formula C36H35BrN2O6
MDL Number MFCD28167761
Molecular Weight 671.59
MOL File 845533-86-0.mol

Chemical Properties

storage temp.  Inert atmosphere,Room Temperature
solubility  DMSO : 100 mg/mL (148.90 mM; Need ultrasonic)H2O : < 0.1 mg/mL (insoluble)
form  Powder
color  White to off-white
InChIKey ZLVSPMRFRHMMOY-KZDJUSSONA-N
SMILES C(/C(=O)O)=C\C(=O)O.[C@](C1=CC=CC2C=CC=CC1=2)(O)(CCN(C)C)[C@H](C1C=CC=CC=1)C1=CC2C=C(Br)C=CC=2N=C1OC |&1:8,25,r|

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Hazard Information

Supplier