3420-72-2

Name 2'-HYDROXY-4,4',6'-TRIMETHOXYCHALCONE
CAS 3420-72-2
Molecular Formula C18H18O5
MDL Number MFCD00017174
Molecular Weight 314.33
MOL File 3420-72-2.mol
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Chemical Properties

Melting point  112-116 °C(lit.)
Boiling point  529.9±50.0 °C(Predicted)
density  1?+-.0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Solid
pka 6.78±0.40(Predicted)
color  Pale Yellow to Light Yellow
InChI 1S/C18H18O5/c1-21-13-7-4-12(5-8-13)6-9-15(19)18-16(20)10-14(22-2)11-17(18)23-3/h4-11,20H,1-3H3/b9-6+
InChIKey CGIBCVBDFUTMPT-RMKNXTFCSA-N
SMILES COc1ccc(\C=C\C(=O)c2c(O)cc(OC)cc2OC)cc1
CAS DataBase Reference 3420-72-2(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
WGK Germany  3
HS Code  2914.50.3000
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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