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N4-Benzoylcytosine Structure

N4-Benzoylcytosine

Chemical Properties

Melting point >300 °C (dec.) (lit.)
Density  1.33±0.1 g/cm3(Predicted)
vapor pressure  0Pa at 25℃
storage temp.  under inert gas (nitrogen or Argon) at 2-8°C
solubility  Aqueous Acid (Slightly, Heated), DMSO+DCl (Slightly, Heated)
pka 7.75±0.10(Predicted)
form  Solid
color  Off-White
InChI InChI=1S/C11H9N3O2/c15-10(8-4-2-1-3-5-8)13-9-6-7-12-11(16)14-9/h1-7H,(H2,12,13,14,15,16)
InChIKey XBDUZBHKKUFFRH-UHFFFAOYSA-N
SMILES C(NC1=CC=NC(=O)N1)(=O)C1=CC=CC=C1
Surface tension 72.2mN/m at 1g/L and 21.2℃
CAS DataBase Reference 26661-13-2(CAS DataBase Reference)

Safety Information

Hazard Codes  Xi
Risk Statements  20/22-36/37/38
Safety Statements  26-36
WGK Germany  3
HS Code  29335990

MSDS

Usage And Synthesis

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