1-[(Methylsulfinyl)methyl]naphthalene
Basic information
- CAS
13183-58-9- Standard SMILES
CS(=O)Cc1cccc2ccccc12- InChIKey
IGBDIDOPGDLMMN-UHFFFAOYSA-N- Molecular formula
- C12H12OS
- Average molar mass
- 204.29 g/mol
- Monoisotopic mass
- 204.06088618
Names & identifiers
- Preferred name
- 1-[(Methylsulfinyl)methyl]naphthalene
- IUPAC
- 1-(methylsulfinylmethyl)naphthalene
Names & synonyms
13183-58-91-[(methylsulfinyl)methyl]naphthaleneNSC140216Naphthalene,1-[(methylsulfinyl)methyl]-DTXSID503009611-[(Methanesulfinyl)methyl]naphthaleneNSC-140216DS-011981
Database identifiers
- CAS
13183-58-9- PubChem CID
- 284401
- DTXSID
DTXSID50300961
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 36.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 214
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…