5230-87-5

Name ANISATIN
CAS 5230-87-5
Molecular Formula C15H20O8
MDL Number MFCD01683844
Molecular Weight 328.31
MOL File 5230-87-5.mol
show more

Chemical Properties

Melting point  227-228℃
Boiling point  609.5±55.0 °C(Predicted)
density  1.63±0.1 g/cm3 (20 ºC 760 Torr)
storage temp.  ?20°C
form  neat
pka 12.01±0.70(Predicted)
color  White to off-white
Major Application food and beverages
InChI 1S/C15H20O8/c1-6-3-7(16)15(21)13(6)4-8(23-10(18)9(13)17)12(2,20)14(15)5-22-11(14)19/h6-9,16-17,20-21H,3-5H2,1-2H3/t6-,7-,8-,9+,12+,13+,14+,15-/m1/s1
InChIKey GEVWHIDSUOMVRI-QWNPAUMXSA-N
SMILES O1[C@H]2[C@@]([C@]3([C@@]4([C@@]([C@@H](C[C@H]4O)C)([C@H](C1=O)O)C2)O)COC3=O)(O)C
LogP -0.930 (est)

Safety Data

Hazard Codes  T+
Risk Statements 
Safety Statements 
RIDADR  UN 2811 6.1 / PGII
WGK Germany  3
RTECS  WH1314700
Storage Class 6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
Hazard Classifications Acute Tox. 2 Inhalation
Acute Tox. 2 Oral
Toxicity
LDLo orl-mus: 1 mg/kg CPBTAL 44,1908,1996

Hazard Information

Supplier

Related Products

Send Inquriy