Basic information
- CAS
22900-41-0- Standard SMILES
CC(=O)c1ccc(C(C)(C)c2ccc(C(C)=O)s2)s1- InChIKey
SVGCMFAUEMNOAD-UHFFFAOYSA-N- Molecular formula
- C15H16O2S2
- Average molar mass
- 292.4 g/mol
- Monoisotopic mass
- 292.0591721
Names & identifiers
- Preferred name
- Ethanone, 1,1'-[(1-methylethylidene)di-5,2-thiophenediyl]bis-
- IUPAC
- 1-[5-[2-(5-acetylthiophen-2-yl)propan-2-yl]thiophen-2-yl]ethanone
Names & synonyms
22900-41-0HMS2327G24SMR000039082Ethanone, 1,1'-[(1-methylethylidene)di-5,2-thiophenediyl]bis-MLS000079820CHEMBL1483763REGID_for_CID_658149DTXSID90349713STL324667AKOS0220990941,1'-(propane-2,2-diyldithiene-5,2-diyl)diethanone1,1'-(5,5'-(Propane-2,2-diyl)bis(thiophene-5,2-diyl))diethanone
Show more names
1,1'-[Propane-2,2-diyldi(thiophene-5,2-diyl)]di(ethan-1-one)
Database identifiers
- CAS
22900-41-0- PubChem CID
- 658149
- DTXSID
DTXSID90349713- ChEMBL
CHEMBL1483763
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 90.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 344
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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