16506-27-7

Name Bendamustine
CAS 16506-27-7
Molecular Formula C16H21Cl2N3O2
MDL Number MFCD00866481
Molecular Weight 358.26
MOL File 16506-27-7.mol

Chemical Properties

Boiling point  585.2±50.0 °C(Predicted)
density  1.31±0.1 g/cm3(Predicted)
storage temp.  -20°C, protect from light
solubility  DMSO : 100 mg/mL (279.13 mM; Need ultrasonic)
form  Solid
pka 4.50±0.10(Predicted)
color  White to off-white
InChI InChI=1S/C16H21Cl2N3O2/c1-20-14-6-5-12(21(9-7-17)10-8-18)11-13(14)19-15(20)3-2-4-16(22)23/h5-6,11H,2-4,7-10H2,1H3,(H,22,23)
InChIKey YTKUWDBFDASYHO-UHFFFAOYSA-N
SMILES C1(CCCC(O)=O)N(C)C2=CC=C(N(CCCl)CCCl)C=C2N=1

Safety Data

Symbol(GHS)  Health Hazard (GHS08)Skull and Crossbones (GHS06)
GHS08,GHS06
Signal word  Danger
Hazard statements  H360-H341-H351-H301
Precautionary statements  P264-P270-P301+P310-P321-P330-P405-P501-P201-P202-P281-P308+P313-P405-P501-P201-P202-P281-P308+P313-P405-P501
Hazardous Substances Data 16506-27-7(Hazardous Substances Data)

Hazard Information

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