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4,7-Di(2-thienyl)-2,1,3-benzothiadiazole

Catalog Number
ACM165190761
Product Name
4,7-Di(2-thienyl)-2,1,3-benzothiadiazole
Structure
CAS
165190-76-1
Category
Small Molecule Semiconductor Building Blocks
Synonyms
4,7-Di(thiophen-2-yl)benzo[c][1,2,5]thiadiazole
IUPAC Name
4,7-dithiophen-2-yl-2,1,3-benzothiadiazole
Molecular Weight
300.41
Molecular Formula
C14H8N2S3
Canonical SMILES
C1=CSC(=C1)C2=CC=C(C3=NSN=C23)C4=CC=CS4
InChI
InChI=1S/C14H8N2S3/c1-3-11(17-7-1)9-5-6-10(12-4-2-8-18-12)14-13(9)15-19-16-14/h1-8H
InChI Key
XGERJWSXTKVPSV-UHFFFAOYSA-N
Melting Point
124 °C
Purity
>98.0%(HPLC)(N)
Appearance
Orange to Red powder to crystal
Storage
Store under inert gas
Complexity
298
Covalently-Bonded Unit Count
1
Exact Mass
299.984962g/mol
Formal Charge
0
Hazard Statements
H302-H315-H319-H335
Heavy Atom Count
19
MDL Number
MFCD18252231
Monoisotopic Mass
299.984962g/mol
NSC Number
701994
Precautionary Statements
P261-P305+P351+P338
Rotatable Bond Count
2
Signal Word
Warning
XLogP3
4.5
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