2597-56-0

Name 2-Methoxy-4-nitrobenzoic acid
CAS 2597-56-0
EINECS(EC#) 219-998-6
Molecular Formula C8H7NO5
MDL Number MFCD00216573
Molecular Weight 197.14
MOL File 2597-56-0.mol
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Chemical Properties

Appearance White to Off-White Crystalline Solid
Melting point  146-148 °C (lit.)
Boiling point  390.9±27.0 °C(Predicted)
density  1.430±0.06 g/cm3(Predicted)
storage temp.  Storage temp. 2-8°C
solubility  Acetic Acid, Methanol
form  Solid
pka 3.13±0.13(Predicted)
color  White to Off-White
InChI 1S/C8H7NO5/c1-14-7-4-5(9(12)13)2-3-6(7)8(10)11/h2-4H,1H3,(H,10,11)
InChIKey KPJXEWJRJKEOCD-UHFFFAOYSA-N
SMILES COc1cc(ccc1C(O)=O)[N+]([O-])=O
CAS DataBase Reference 2597-56-0(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  29189900
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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