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5-Chlorouracil Structure

5-Chlorouracil

Chemical Properties

Melting point >300 °C (lit.)
Density  1.6838 (rough estimate)
refractive index  1.6550 (estimate)
storage temp.  2-8°C
solubility  1 M NH4OH: soluble50mg/mL
pka 6.77±0.10(Predicted)
form  Solid
color  White to Off-White
Water Solubility  2.501g/L(25 ºC)
BRN  127173
InChI InChI=1S/C4H3ClN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
InChIKey ZFTBZKVVGZNMJR-UHFFFAOYSA-N
SMILES C1(=O)NC=C(Cl)C(=O)N1
CAS DataBase Reference 1820-81-1(CAS DataBase Reference)
FDA UNII 7LQ4V03RNY
EPA Substance Registry System 5-Chlorouracil (1820-81-1)

Safety

Symbol(GHS)
Signal wordDanger
Hazard statements H301-H341
Precautionary statements P201-P202-P264-P270-P280-P301+P310
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  22-24/25-36-26
WGK Germany  3
RTECS  YQ9410000
HS Code  29335995
NFPA 704:
1
0 0

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5-Chlorouracil Chemical Properties,Usage,Production

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