1,3-Diallylurea Structure

1,3-Diallylurea

Chemical Properties

Melting point 90-93 °C(lit.)
Boiling point 56°C/10mmHg(lit.)
Density  1.0897 (rough estimate)
refractive index  1.4880 (estimate)
solubility  soluble in Methanol
form  powder to crystal
pka 13.86±0.46(Predicted)
color  White to Almost white
InChI InChI=1S/C7H12N2O/c1-3-5-8-7(10)9-6-4-2/h3-4H,1-2,5-6H2,(H2,8,9,10)
InChIKey QRWVOJLTHSRPOA-UHFFFAOYSA-N
SMILES N(CC=C)C(NCC=C)=O
CAS DataBase Reference 1801-72-5(CAS DataBase Reference)
FDA UNII LXM0XY469I

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302-H315-H319-H335
Precautionary statements P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
WGK Germany  3
HS Code  2924190090

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