110448-29-8

Name ethyl 6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
CAS 110448-29-8
Molecular Formula C14H15N3O5
MDL Number MFCD00128568
Molecular Weight 305.29
MOL File 110448-29-8.mol
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Chemical Properties

Melting point  226-227.5 °C
Boiling point  444.3±45.0 °C(Predicted)
density  1.302±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  DMSO: 10mg/mL, clear
form  powder
pka 10.86±0.70(Predicted)
color  white to beige
InChI 1S/C14H15N3O5/c1-3-22-13(18)11-8(2)15-14(19)16-12(11)9-5-4-6-10(7-9)17(20)21/h4-7,12H,3H2,1-2H3,(H2,15,16,19)
InChIKey PPBNQKLDXXHPMH-UHFFFAOYSA-N
SMILES O=C(OCC)C1=C(C)NC(NC1C2=CC([N+]([O-])=O)=CC=C2)=O

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Eye Irrit. 2

Hazard Information

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