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870485-21-5

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870485-21-5 Structure

870485-21-5 Structure
IdentificationBack Directory
[Name]

4-(7-溴本并噻二-4-基)苯甲醛
[CAS]

870485-21-5
[Synonyms]

Benzaldehyde, 4-(7-bromo-2,1,3-benzothiadiazol-4-yl)-
4-(7- bromobenzo[c][1,2,5]thiadiazol-4-yl)benzaldehyd
4-(7- bromobenzo[c][1,2,5]thiadiazol-4-yl)benzaldehyde
[Molecular Formula]

C13H7BrN2OS
[MOL File]

870485-21-5.mol
[Molecular Weight]

319.18
Chemical PropertiesBack Directory
[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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