2-Benzo[a]anthracen-12-ylthiophene
Basic information
- CAS
1236-22-2- Standard SMILES
c1csc(-c2c3ccccc3cc3ccc4ccccc4c23)c1- InChIKey
RQURPFUQOGTHLK-UHFFFAOYSA-N- Molecular formula
- C22H14S
- Average molar mass
- 310.4 g/mol
- Monoisotopic mass
- 310.08162162
Names & identifiers
- Preferred name
- 2-Benzo[a]anthracen-12-ylthiophene
- IUPAC
- 2-benzo[a]anthracen-12-ylthiophene
Names & synonyms
1236-22-22-benzo[a]anthracen-12-ylthiophene2-(Tetraphen-12-yl)thiopheneDTXSID40398352NSC99493NSC-994932-BENZ[A]ANTHRACEN-12-YLTHIOPHENE
Database identifiers
- CAS
1236-22-2- PubChem CID
- 3977758
- DTXSID
DTXSID40398352
Properties
Computed structural properties
- XLogP
- 7
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 418
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Related reactions
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Compound notes
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