3(2H)-Thiophenone, 4-hydroxy-2,5-di-2-naphthalenyl-, 1,1-dioxide
Basic information
- CAS
49647-61-2- Standard SMILES
O=C1C(O)=C(c2ccc3ccccc3c2)S(=O)(=O)C1c1ccc2ccccc2c1- InChIKey
UZQLUIWYHBDCCU-UHFFFAOYSA-N- Molecular formula
- C24H16O4S
- Average molar mass
- 400.4 g/mol
- Monoisotopic mass
- 400.07693016
Names & identifiers
- Preferred name
- 3(2H)-Thiophenone, 4-hydroxy-2,5-di-2-naphthalenyl-, 1,1-dioxide
- IUPAC
- 4-hydroxy-2,5-dinaphthalen-2-yl-1,1-dioxothiophen-3-one
Names & synonyms
49647-61-23(2H)-Thiophenone, 4-hydroxy-2,5-di-2-naphthalenyl-, 1,1-dioxideRefChem:269699UZQLUIWYHBDCCU-UHFFFAOYSA-NDTXSID1011720712,3-Dihydro-2,5-bis[2-naphthyl]thiophen-4-ol-3-one-1,1-dioxide4-Hydroxy-2,5-di(2-naphthyl)-3(2H)-thiophenone 1,1-dioxide #4-Hydroxy-2,5-di(naphthalen-2-yl)-1H-1lambda~6~-thiophene-1,1,3(2H)-trione
Database identifiers
- CAS
49647-61-2- PubChem CID
- 597789
- DTXSID
DTXSID101172071
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 79.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 792
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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