2-[(7-Bromo-2,1,3-benzothiadiazol-4-yl)methylene]malononitrile

Name: 2-[(7-Bromo-2,1,3-benzothiadiazol-4-yl)methylene]malononitrile
SKU: ACM1335150101
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Catalog NumberACM1335150101

CAS Number1335150-10-1

CategorySmall Molecule Semiconductor Building Blocks

IUPAC Name

2-[(4-bromo-2,1,3-benzothiadiazol-7-yl)methylidene]propanedinitrile

Molecular Weight

291.13g/mol

Molecular Formula

C10H3BrN4S

Canonical SMILES

C1=C(C2=NSN=C2C(=C1)Br)C=C(C#N)C#N

InChI

InChI=1S/C10H3BrN4S/c11-8-2-1-7(3-6(4-12)5-13)9-10(8)15-16-14-9/h1-3H

InChI Key

ZNWYPDKJWGLSQU-UHFFFAOYSA-N

Complexity

386

Covalently-Bonded Unit Count

Exact Mass

289.92618g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

289.92618g/mol

Rotatable Bond Count

XLogP3

2.6

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