42590-00-1

Name Methyl 4-hydroxy-3-methoxy-5-nitrobenzenecarboxylate
CAS 42590-00-1
Molecular Formula C9H9NO6
MDL Number MFCD06203667
Molecular Weight 227.17
MOL File 42590-00-1.mol
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Chemical Properties

Melting point  154-155 °C
Boiling point  354.1±37.0 °C(Predicted)
density  1.405±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
form  crystalline solid
pka 5.36±0.38(Predicted)
color  Golden tan
InChI InChI=1S/C9H9NO6/c1-15-7-4-5(9(12)16-2)3-6(8(7)11)10(13)14/h3-4,11H,1-2H3
InChIKey ZQIHGTCQYHQBMY-UHFFFAOYSA-N
SMILES C(OC)(=O)C1=CC([N+]([O-])=O)=C(O)C(OC)=C1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P271-P261
HazardClass  IRRITANT
HS Code  2918300090

Spectrum Detail

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