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Structure

3,5-Dibromodithieno[3,2-b:2',3'-d]thiophene

CAS
502764-54-7
Catalog Number
ACM502764547
Category
Other Products
Molecular Weight
354.1g/mol
Molecular Formula
C8H2Br2S3

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Specification

IUPAC Name
5,9-dibromo-3,7,11-trithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene
Canonical SMILES
C1=C(C2=C(S1)C3=C(S2)C(=CS3)Br)Br
InChI
InChI=1S/C8H2Br2S3/c9-3-1-11-7-5(3)13-6-4(10)2-12-8(6)7/h1-2H
InChI Key
MFLUNTNNZSCLFW-UHFFFAOYSA-N
Complexity
203
Covalently-Bonded Unit Count
1
Exact Mass
353.76649g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
0
Heavy Atom Count
13
Monoisotopic Mass
351.76854g/mol
Rotatable Bond Count
0
XLogP3
5.2
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