1222-98-6

Name 4-NITROCHALCONE
CAS 1222-98-6
EINECS(EC#) 214-949-5
Molecular Formula C15H11NO3
MDL Number MFCD00007382
Molecular Weight 253.25
MOL File 1222-98-6.mol
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Chemical Properties

Appearance yellow to brown crystalline powder
Melting point  158-160 °C (lit.)
Boiling point  396.45°C (rough estimate)
density  1.1934 (rough estimate)
refractive index  1.5500 (estimate)
form  powder to crystal
color  Light orange to Yellow to Green
BRN  400543
InChI 1S/C15H11NO3/c17-15(13-4-2-1-3-5-13)11-8-12-6-9-14(10-7-12)16(18)19/h1-11H/b11-8+
InChIKey WDZGGAFMGIOIQS-DHZHZOJOSA-N
SMILES [O-][N+](=O)c1ccc(\C=C\C(=O)c2ccccc2)cc1
CAS DataBase Reference 1222-98-6(CAS DataBase Reference)
EPA Substance Registry System 2-Propen-1-one, 3-(4-nitrophenyl)-1-phenyl- (1222-98-6)

Safety Data

Hazard Codes  Xi
Safety Statements 
S24/25:Avoid contact with skin and eyes .
WGK Germany  2
RTECS  FL7075500
TSCA  Yes
HS Code  29147000
Storage Class 11 - Combustible Solids

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