870485-21-5

Name 4-(7-溴本并噻二-4-基)苯甲醛
CAS 870485-21-5
Molecular Formula C13H7BrN2OS
Molecular Weight 319.18
MOL File 870485-21-5.mol
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Chemical Properties

Melting point  205-206 °C
Boiling point  462.9±35.0 °C(Predicted)
density  1.657±0.06 g/cm3(Predicted)
pka -1.99±0.50(Predicted)
InChI InChI=1S/C13H7BrN2OS/c14-11-6-5-10(12-13(11)16-18-15-12)9-3-1-8(7-17)2-4-9/h1-7H
InChIKey ZCAQEBYEKMZHBC-UHFFFAOYSA-N
SMILES C(=O)C1=CC=C(C2C3C(C(Br)=CC=2)=NSN=3)C=C1

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