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5,5''-Dibromo-2,2':5',2''-terthiophene

Catalog Number
ACM98057080-1
Product Name
5,5''-Dibromo-2,2':5',2''-terthiophene
Structure
CAS
98057-08-0
Category
Electroluminescence Materials
Synonyms
2,5-Bis(5-bromothiophen-2-yl)thiophene
IUPAC Name
2,5-bis(5-bromothiophen-2-yl)thiophene
Molecular Weight
406.2g/mol
Molecular Formula
C12H6Br2S3
SMILES
Brc1ccc(s1)-c2ccc(s2)-c3ccc(Br)s3
InChI
1S/C12H6Br2S3/c13-11-5-3-9(16-11)7-1-2-8(15-7)10-4-6-12(14)17-10/h1-6H
InChIKey
KXFPYYJGYVYXIB-UHFFFAOYSA-N
Melting Point
150-155 °C
Storage
room temp
NSC Number
700236
Packaging
500 mg in glass bottle
Status
0
Complexity
251
Formal Charge
0
Exact Mass
405.79779g/mol
Monoisotopic Mass
403.79984g/mol
XLogP3
6.4
UNII
HI93T94CTM
Covalently-Bonded Unit Count
1
Heavy Atom Count
17
Rotatable Bond Count
2
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