17896-21-8

Name Citiolone
CAS 17896-21-8
EINECS(EC#) 214-793-8
Molecular Formula C6H9NO2S
MDL Number MFCD00005480
Molecular Weight 159.21
MOL File 17896-21-8.mol
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Chemical Properties

Appearance White to off-white crystalline powder
Melting point  109-111 °C
density  1.202 (estimate)
refractive index  1.5500 (estimate)
storage temp.  -20°C
form  Crystalline Powder
color  White to off-white
InChI InChI=1S/C6H9NO2S/c1-4(8)7-5-2-3-10-6(5)9/h5H,2-3H2,1H3,(H,7,8)
InChIKey NRFJZTXWLKPZAV-UHFFFAOYSA-N
SMILES C1(NC(=O)C)CCSC1=O
CAS DataBase Reference 17896-21-8(CAS DataBase Reference)
EPA Substance Registry System 17896-21-8(EPA Substance)

Safety Data

Hazard Codes  T
Risk Statements 
Safety Statements 
S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
WGK Germany  3
RTECS  AC8680000
HS Code  29349990
Toxicity
mouse,LD50,intravenous,1200mg/kg (1200mg/kg),Arzneimittel-Forschung. Drug Research. Vol. 8, Pg. 72, 1958.

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