1076-59-1

Name 3-PHENYL-5-ISOXAZOLONE
CAS 1076-59-1
EINECS(EC#) 214-064-4
Molecular Formula C9H7NO2
MDL Number MFCD00003158
Molecular Weight 161.16
MOL File 1076-59-1.mol
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Chemical Properties

Appearance light beige to pink crystalline solid
Melting point  155-158 °C(lit.)
Boiling point  248.1±23.0℃ (760 Torr)
density  1.25±0.1 g/cm3 (20 ºC 760 Torr)
refractive index  1.5050 (estimate)
Fp  117.8±17.1℃
storage temp.  Store at room temperature
form  Crystalline Solid
color  Light beige to pink
BRN  5075
InChI 1S/C9H7NO2/c11-9-6-8(10-12-9)7-4-2-1-3-5-7/h1-5H,6H2
InChIKey IHKNLPPRTQQACK-UHFFFAOYSA-N
SMILES O=C1CC(=NO1)c2ccccc2
CAS DataBase Reference 1076-59-1(CAS DataBase Reference)
EPA Substance Registry System 5(4H)-Isoxazolone, 3-phenyl- (1076-59-1)

Safety Data

Hazard Codes  T
Risk Statements 
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S24/25:Avoid contact with skin and eyes .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
WGK Germany  3
TSCA  Yes
HS Code  29349990
Storage Class 11 - Combustible Solids

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