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2-Decyl-7-phenyl[1]benzothieno[3,2-b][1]benzothiophene

Catalog Number
ACM1398395839
CAS Number
1398395-83-9
Product Name
2-Decyl-7-phenyl[1]benzothieno[3,2-b][1]benzothiophene
Category
Small Molecule Semiconductor Building Blocks; Organic Field Effect Transistor (OFET) Materials; Organic Semiconductors
Synonyms
Ph-BTBT-C10
2-Decyl-7-phenylbenzo[b]benzo[4,5]thieno[2,3-d]thiophene
Ph-BTBT-10
IUPAC Name
7-decyl-2-phenyl-[1]benzothiolo[3,2-b][1]benzothiole
Molecular Weight
456.71
Molecular Formula
C30H32S2
Canonical SMILES
CCCCCCCCCCC1=CC2=C(C=C1)C3=C(S2)C4=C(S3)C=C(C=C4)C5=CC=CC=C5
InChI
InChI=1S/C30H32S2/c1-2-3-4-5-6-7-8-10-13-22-16-18-25-27(20-22)31-30-26-19-17-24(21-28(26)32-29(25)30)23-14-11-9-12-15-23/h9,11-12,14-21H,2-8,10,13H2,1H3
InChI Key
ZIQBVBKYAZMQPC-UHFFFAOYSA-N
Melting Point
225 °C
Purity
>99.5%(HPLC)
Appearance
White to Light yellow powder to crystal
Storage
Store under inert gas
Complexity
555
Covalently-Bonded Unit Count
1
Exact Mass
456.194543g/mol
Formal Charge
0
Hazard Statements
H413 : May cause long lasting harmful effects to aquatic life.
Heavy Atom Count
32
MDL Number
MFCD00010719
Monoisotopic Mass
456.194543g/mol
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P273 : Avoid release to the environment.
Rotatable Bond Count
10
Signal Word
Warning
XLogP3
12.1
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