2,2'-Bithiophene - CAS 492-97-7
Catalog: |
BB026683 |
Product Name: |
2,2'-Bithiophene |
CAS: |
492-97-7 |
Synonyms: |
2-thiophen-2-ylthiophene |
IUPAC Name: | 2-thiophen-2-ylthiophene |
Description: | 2,2'-Bithiophene (CAS# 492-97-7) is a reactant in the preparation of thienophenyl compounds. |
Molecular Weight: | 166.26 |
Molecular Formula: | C8H6S2 |
Canonical SMILES: | C1=CSC(=C1)C2=CC=CS2 |
InChI: | InChI=1S/C8H6S2/c1-3-7(9-5-1)8-4-2-6-10-8/h1-6H |
InChI Key: | OHZAHWOAMVVGEL-UHFFFAOYSA-N |
Boiling Point: | 260 °C |
Melting Point: | 32-33 °C |
Flash Point: | 110 °C |
Purity: | > 98.0 % (GC) |
Density: | 1.243 g/cm3 |
Appearance: | White to light yellow crystal powder |
MDL: | MFCD00005414 |
LogP: | 3.47660 |
Vapor Pressure: | 0.00119 [mmHg] |
GHS Hazard Statement: | H302 (25%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (25%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (75%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (75%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (25%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P280-P301+P312-P302+P352-P304+P340 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
23060146 | 20121128 | Local electronic properties at organic-metal interfaces: thiophene derivatives on Pt(111) | Physical chemistry chemical physics : PCCP |
22951990 | 20121107 | Intermolecular electron transfer promoted by directional donor-acceptor attractions in self-assembled diketopyrrolopyrrole-thiophene films | Physical chemistry chemical physics : PCCP |
22842351 | 20121101 | The synthesis, crystal structure and enhanced blue fluorescence emission of novel antipyrine derivatives | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
22903073 | 20121014 | Thiocyanate-free cyclometalated ruthenium sensitizers for solar cells based on heteroaromatic-substituted 2-arylpyridines | Dalton transactions (Cambridge, England : 2003) |
22898903 | 20121004 | Two-photon fluorescent microporous bithiophene polymer via Suzuki cross-coupling | Chemical communications (Cambridge, England) |
Complexity: | 99.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 165.99109254 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.99109254 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 56.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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