Basic information
- CAS
91544-06-8- Standard SMILES
Cc1cc(-c2cc(C)c(C=O)s2)sc1C=O- InChIKey
COLVKENZVZRPJD-UHFFFAOYSA-N- Molecular formula
- C12H10O2S2
- Average molar mass
- 250.3 g/mol
- Monoisotopic mass
- 250.0122219
Names & identifiers
- Preferred name
- [2,2'-Bithiophene]-5,5'-dicarboxaldehyde, 4,4'-dimethyl-
- IUPAC
- 5-(5-formyl-4-methylthiophen-2-yl)-3-methylthiophene-2-carbaldehyde
Names & synonyms
91544-06-84,4'-Dimethyl-[2,2'-bithiophene]-5,5'-dicarbaldehyde[2,2'-Bithiophene]-5,5'-dicarboxaldehyde, 4,4'-dimethyl-NSC600016SCHEMBL12215859DTXSID30326528NSC-6000164,4'-Dimethyl[2,2'-bithiophene]-5,5'-dicarbaldehyde
Database identifiers
- CAS
91544-06-8- PubChem CID
- 353024
- DTXSID
DTXSID30326528
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 90.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 254
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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