2,5-Di-(2'-thienyl)furan
Basic information
- CAS
88089-34-3- Standard SMILES
c1csc(-c2ccc(-c3cccs3)o2)c1- InChIKey
FEBXMKWMRKJKKW-UHFFFAOYSA-N- Molecular formula
- C12H8OS2
- Average molar mass
- 232.3 g/mol
- Monoisotopic mass
- 232.00165722
Overview
analog of terthienyl; structure given in first source
Names & identifiers
- Preferred name
- 2,5-Di-(2'-thienyl)furan
- IUPAC
- 2,5-dithiophen-2-ylfuran
- English name
- 2,5-di-(2'-thienyl)furan
- Molecular formula
- C12H8OS2
- Molecular weight
- 232.32
Names & synonyms
88089-34-32,5-Di-(2'-thienyl)furan2,5-DitfDTXSID00236807Furan, 2,5-di-2-thienyl-, (4aR-trans)-RefChem:82740DTXCID901592982,5-dithiophen-2-ylfuran2,5-Di(thiophen-2-yl)furan2,5-di(2-thienyl)furan2,5-bis(2-thienyl)furanNSC671956
Show more names
2,5-bis(thiophen-2-yl)furan
2,5-Di-2-thienylfuran2,5-di(2'-thienyl)furanSCHEMBL499141Furan, 2,5-di-2-thienyl-NSC-671956DB-134122AE-508/36397018
Database identifiers
- CAS
88089-34-3- PubChem CID
- 137385
- DTXSID
DTXSID00236807- Nikkaji
- J1.050.117B
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 200
Physicochemical properties
- Melting point
- 81 · 81-82 °C
- Boiling point
- 338.1 · 338.1±32.0 °C(Predicted)
- Density
- 1.278 · 1.278±0.06 g/cm3(Predicted)
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Compound notes
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