Basic information
- CAS
65480-49-1- Standard SMILES
c1ccc(C2OC(CCC3SCCCS3)OC2c2ccccc2)cc1- InChIKey
TVHILVXEVBQJAU-UHFFFAOYSA-N- Molecular formula
- C21H24O2S2
- Average molar mass
- 372.5 g/mol
- Monoisotopic mass
- 372.12177235
Names & identifiers
- Preferred name
- 2-[2-(1,3-Dithian-2-yl)ethyl]-4,5-diphenyl-1,3-dioxolane
- IUPAC
- 2-[2-(1,3-dithian-2-yl)ethyl]-4,5-diphenyl-1,3-dioxolane
Names & synonyms
65480-49-12-[2-(1,3-Dithian-2-yl)ethyl]-4,5-diphenyl-1,3-dioxolaneDTXSID30494771
Database identifiers
- CAS
65480-49-1- PubChem CID
- 12370061
- DTXSID
DTXSID30494771
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 69.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 361
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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