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Tetrakis(methylthio)tetrathiafulvalene [Organic Electronic Material] - >96.0%(GC), high purity , CAS No.51501-77-0
Basic Description
Synonyms | FT-0735542 | 4,4',5,5'-Tetrakis(methylsulfanyl)tetrathiafulvalene | DTXSID60348258 | LLLXUARUONPZIY-UHFFFAOYSA-N | T1119 | MFCD00059747 | 1,3-Dithiole,2-[4,5-bis(ethylthio)-1,3-dithiol-2-ylidene]-4,5-bis(ethylthio)- | Tetrakis(methylthio)tetrathiafulvalen |
Specifications & Purity | ≥96%(GC) |
Shipped In | Normal |
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Names and Identifiers
IUPAC Name | 2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-4,5-bis(methylsulfanyl)-1,3-dithiole |
INCHI | InChI=1S/C10H12S8/c1-11-5-6(12-2)16-9(15-5)10-17-7(13-3)8(14-4)18-10/h1-4H3 |
InChi Key | LLLXUARUONPZIY-UHFFFAOYSA-N |
Canonical SMILES | CSC1=C(SC(=C2SC(=C(S2)SC)SC)S1)SC |
Isomeric SMILES | CSC1=C(SC(=C2SC(=C(S2)SC)SC)S1)SC |
PubChem CID | 633638 |
Molecular Weight | 388.69 |
Reaxy-Rn | 1623932 |
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Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Melt Point(°C) | 96 °C |
Molecular Weight | 388.700 g/mol |
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XLogP3 | 5.400 |
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Hydrogen Bond Donor Count | 0 |
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Hydrogen Bond Acceptor Count | 8 |
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Rotatable Bond Count | 4 |
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Exact Mass | 387.87 Da |
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Monoisotopic Mass | 387.87 Da |
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Topological Polar Surface Area | 202.000 Ų |
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Heavy Atom Count | 18 |
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Formal Charge | 0 |
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Complexity | 357.000 |
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Isotope Atom Count | 0 |
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Defined Atom Stereocenter Count | 0 |
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Undefined Atom Stereocenter Count | 0 |
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Defined Bond Stereocenter Count | 0 |
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Undefined Bond Stereocenter Count | 0 |
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The total count of all stereochemical bonds | 0 |
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Covalently-Bonded Unit Count | 1 |
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