2-Isonitrosoacetophenone Structure

2-Isonitrosoacetophenone

Chemical Properties

Melting point 126-128 °C (lit.)
Boiling point 270.21°C (rough estimate)
Density  1.2517 (rough estimate)
refractive index  1.5320 (estimate)
storage temp.  2-8°C
form  powder to crystal
pka 8.49±0.10(Predicted)
color  White to Light yellow to Light orange
Water Solubility  SOLUBLE IN COLD WATER
Merck  14,5191
BRN  2041691
InChI InChI=1S/C8H7NO2/c10-8(6-9-11)7-4-2-1-3-5-7/h1-6,11H/b9-6+
InChIKey MLNKXLRYCLKJSS-RMKNXTFCSA-N
SMILES C1(C=CC=CC=1)C(=O)/C=N/O
CAS DataBase Reference 532-54-7(CAS DataBase Reference)
FDA UNII FFE56234VN
EPA Substance Registry System Isonitrosoacetophenone (532-54-7)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302
Precautionary statements P264-P270-P301+P312a-P330-P501a
Hazard Codes  Xn,Xi
Risk Statements  20/21/22-36/37/38
Safety Statements  36/37-24/25
RIDADR  2811
WGK Germany  3
RTECS  MD3325000
TSCA  TSCA listed
HS Code  2922390090
Storage Class 11 - Combustible Solids
NFPA 704:
1
2 0

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