((1,3-Bis(phenylthio)propyl)thio)benzene
Basic information
- CAS
69519-81-9- Standard SMILES
c1ccc(SCCC(Sc2ccccc2)Sc2ccccc2)cc1- InChIKey
MWYXTMRUSSQKQK-UHFFFAOYSA-N- Molecular formula
- C21H20S3
- Average molar mass
- 368.6 g/mol
- Monoisotopic mass
- 368.07271416
Names & identifiers
- Preferred name
- ((1,3-Bis(phenylthio)propyl)thio)benzene
- IUPAC
- 1,3-bis(phenylsulfanyl)propylsulfanylbenzene
Names & synonyms
((1,3-Bis(phenylthio)propyl)thio)benzene69519-81-9LR0IV8Z6Z1UNII-LR0IV8Z6Z1NSC 271587NSC-271587DTXSID302197691,1',1''-(1-PROPANYL-3-YLIDENETRIS(THIO))TRIS(BENZENE)BENZENE, 1,1',1''-(1-PROPANYL-3-YLIDENETRIS(THIO))TRIS-RefChem:67076DTXCID30142260NSC271587
Show more names
1,3-bis(phenylsulfanyl)propylsulfanylbenzene1,1',1''-[Propane-1,1,3-triyltris(sulfanediyl)]tribenzene
Database identifiers
- CAS
69519-81-9- PubChem CID
- 321322
- DTXSID
DTXSID30219769- UNII
- LR0IV8Z6Z1
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 75.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 295
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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