614-21-1

Name BENZOYLNITROMETHANE
CAS 614-21-1
Molecular Formula C8H7NO3
MDL Number MFCD00010218
Molecular Weight 165.15
MOL File 614-21-1.mol
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Chemical Properties

Appearance white waxy crystalline powder or flakes
Melting point  105-107 °C(lit.)
Boiling point  292.97°C (rough estimate)
density  1.3450 (rough estimate)
refractive index  1.5468 (estimate)
storage temp.  Refrigerator (+4°C)
form  Liquid
pka 5.37±0.29(Predicted)
color  Clear colorless or yellow to red to brown
InChI 1S/C8H7NO3/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-5H,6H2
InChIKey JTWHVBNYYWFXSI-UHFFFAOYSA-N
SMILES [O-][N+](=O)CC(=O)c1ccccc1

Safety Data

Hazard Codes  Xn
Risk Statements 
Safety Statements 
WGK Germany  3
HS Code  29147000
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Eye Irrit. 2

Hazard Information

Spectrum Detail

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