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5'-Bromo-[2,2'-bithiophene]-5-carbonitrile

Catalog Number
ACM176787965
Product Name
5'-Bromo-[2,2'-bithiophene]-5-carbonitrile
CAS
176787-96-5
Category
Small Molecule Semiconductor Building Blocks
IUPAC Name
5-(5-bromothiophen-2-yl)thiophene-2-carbonitrile
Molecular Weight
270.2g/mol
Molecular Formula
C9H4BrNS2
Canonical SMILES
C1=C(SC(=C1)C2=CC=C(S2)Br)C#N
InChI
InChI=1S/C9H4BrNS2/c10-9-4-3-8(13-9)7-2-1-6(5-11)12-7/h1-4H
InChI Key
OHVCHDZJRUEOKH-UHFFFAOYSA-N
Complexity
237
Covalently-Bonded Unit Count
1
Exact Mass
268.89685g/mol
Formal Charge
0
Heavy Atom Count
13
Monoisotopic Mass
268.89685g/mol
Rotatable Bond Count
1
XLogP3
4.1
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