2791273-76-0

Name INDEX NAME NOT YET ASSIGNED
CAS 2791273-76-0
Molecular Formula C13H14BrIN2O
Molecular Weight 421.08
MOL File 2791273-76-0.mol
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Chemical Properties

Boiling point  483.3±45.0 °C(Predicted)
density  2.02±0.1 g/cm3(Predicted)
pka -0.78±0.30(Predicted)
InChI InChI=1S/C13H14BrIN2O/c1-8-6-10-9(12(14)13(8)15)7-16-17(10)11-4-2-3-5-18-11/h6-7,11H,2-5H2,1H3
InChIKey XZCUMXRWNQZRJG-UHFFFAOYSA-N
SMILES BrC1C(=C(C)C=C2N(C3OCCCC3)N=CC=12)I

Spectrum Detail

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