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165190-76-1 | 2,1,3-Benzothiadiazole, 4,7-di-2-thienyl-
CAS No: 165190-76-1 Catalog No: AG001VZC MDL No:MFCD18252231
Product Description
Catalog Number:
AG001VZC
Chemical Name:
2,1,3-Benzothiadiazole, 4,7-di-2-thienyl-
CAS Number:
165190-76-1
Molecular Formula:
C14H8N2S3
Molecular Weight:
300.4217
MDL Number:
MFCD18252231
IUPAC Name:
4,7-dithiophen-2-yl-2,1,3-benzothiadiazole
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
SMILES:
c1csc(c1)c1ccc(c2c1nsn2)c1cccs1
NSC Number:
701994
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.985g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.412g/mol
Monoisotopic Mass:
299.985g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
Literature
| Title | Journal |
|---|---|
| Rational design of organic asymmetric donors D1-A-D2 possessing broad absorption regions and suitable frontier molecular orbitals to match typical acceptors toward solar cells. | The journal of physical chemistry. A 20110526 |
| Optimizing simultaneous two-photon absorption and transient triplet-triplet absorption in platinum acetylide chromophores. | The journal of physical chemistry. A 20100708 |
| Ladder-type oligo-p-phenylene-containing copolymers with high open-circuit voltages and ambient photovoltaic activity. | Journal of the American Chemical Society 20100421 |
| Exciton diffusion in polyfluorene copolymer thin films: kinetics, energy disorder and thermally assisted hopping. | Chemphyschem : a European journal of chemical physics and physical chemistry 20090824 |
| Comparative study on polymer light-emitting devices based on blends of polyfluorene and 4,7-di-2-thienyl-2,1,3-benzothiadiazole with devices based on copolymer of the same composition. | The journal of physical chemistry. B 20070607 |
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