66108-30-3

Name 2'-HYDROXY-5'-METHYL-3'-NITROACETOPHENONE
CAS 66108-30-3
Molecular Formula C9H9NO4
MDL Number MFCD00192216
Molecular Weight 195.17
MOL File 66108-30-3.mol
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Chemical Properties

Melting point  133-136 °C(lit.)
Boiling point  254.0±35.0 °C(Predicted)
density  1.323±0.06 g/cm3(Predicted)
storage temp.  2-8°C, stored under nitrogen
form  powder to crystal
pka 7?+-.0.38(Predicted)
color  Light yellow to Yellow to Orange
InChI InChI=1S/C9H9NO4/c1-5-3-7(6(2)11)9(12)8(4-5)10(13)14/h3-4,12H,1-2H3
InChIKey XSHQMMIEZHWNAK-UHFFFAOYSA-N
SMILES C(=O)(C1=CC(C)=CC([N+]([O-])=O)=C1O)C
CAS DataBase Reference 66108-30-3(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  29147000
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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