535-96-6

Name MAREIN
CAS 535-96-6
EINECS(EC#) 208-623-1
Molecular Formula C21H22O11
MDL Number MFCD00017496
Molecular Weight 450.39
MOL File 535-96-6.mol

Chemical Properties

Melting point  197-202°C
Boiling point  835.4±65.0 °C(Predicted)
density  1.664±0.06 g/cm3(Predicted)
storage temp.  4°C, protect from light
solubility  DMSO: soluble
form  A crystalline solid
pka 6.92±0.40(Predicted)
color  Light yellow to yellow
InChIKey XGEYXJDOVMEJNG-UOWIVAOKNA-N
SMILES [C@@H]1([C@H](O)[C@H]([C@H](O)[C@@H](CO)O1)O)OC1C=CC(C(=O)/C=C/C2C=CC(O)=C(O)C=2)=C(O)C=1O |&1:0,1,3,4,6,r|
LogP -0.180 (est)

Safety Data

Hazard Codes  Xi

Hazard Information

Spectrum Detail

Supplier