4694-91-1

Name 6-NITRO BENZOXAZOLINONE
CAS 4694-91-1
EINECS(EC#) 225-157-4
Molecular Formula C7H4N2O4
MDL Number MFCD00092622
Molecular Weight 180.12
MOL File 4694-91-1.mol
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Chemical Properties

Melting point  248-252 °C(lit.)
density  1.580±0.06 g/cm3(Predicted)
storage temp.  Store at room temperature
form  Powder or Needles
pka 7.89±0.70(Predicted)
color  White to off-white
InChI 1S/C7H4N2O4/c10-7-8-5-2-1-4(9(11)12)3-6(5)13-7/h1-3H,(H,8,10)
InChIKey JGYJZHYTADCWIK-UHFFFAOYSA-N
SMILES [O-][N+](=O)c1ccc2NC(=O)Oc2c1
CAS DataBase Reference 4694-91-1(CAS DataBase Reference)
EPA Substance Registry System 2(3H)-Benzoxazolone, 6-nitro- (4694-91-1)

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
TSCA  Yes
HS Code  29349990
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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