54686-97-4

Name 1,3:2,4-Di-p-methylbenzylidene sorbitol
CAS 54686-97-4
EINECS(EC#) 611-185-8
Molecular Formula C22H26O6
MDL Number MFCD02099187
Molecular Weight 386.44
MOL File 54686-97-4.mol

Chemical Properties

Melting point  255-262°C
Water Solubility  <0.01 g/100 mL at 20 ºC
InChI InChI=1/C22H26O6/c1-13-3-7-15(8-4-13)21-25-12-18-20(28-21)19(17(24)11-23)27-22(26-18)16-9-5-14(2)6-10-16/h3-10,17-24H,11-12H2,1-2H3/t17-,18+,19-,20-,21?,22?/s3
InChIKey LQAFKEDMOAMGAK-YYTYHAIYNA-N
SMILES [C@]12([H])[C@]([H])(COC(C3C=CC(C)=CC=3)O1)OC(C1C=CC(C)=CC=1)O[C@]2([H])[C@@H](CO)O |&1:0,2,25,27,r|

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H319-H315-H335
Precautionary statements  P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P

Hazard Information

Supplier