(4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one
Basic information
- CAS
62082-20-6- Standard SMILES
CSC(=S)c1ccc(O)c2ccccc12- InChIKey
TZGNQUXJSKFTJU-UHFFFAOYSA-N- Molecular formula
- C12H10OS2
- Average molar mass
- 234.3 g/mol
- Monoisotopic mass
- 234.01730729
Names & identifiers
- Preferred name
- (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one
- IUPAC
- methyl 4-hydroxynaphthalene-1-carbodithioate
Names & synonyms
62082-20-6NSC292258DTXSID90421982(4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-oneNSC-292258
Database identifiers
- CAS
62082-20-6- PubChem CID
- 324997
- DTXSID
DTXSID90421982
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 77.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 242
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…