6H-Dibenzo[b,d]thiopyran
Basic information
- CAS
230-04-6- Standard SMILES
c1ccc2c(c1)CSc1ccccc1-2- InChIKey
CDWKIEQLLOVYHY-UHFFFAOYSA-N- Molecular formula
- C13H10S
- Average molar mass
- 198.29 g/mol
- Monoisotopic mass
- 198.05032149
Names & identifiers
- Preferred name
- 6H-Dibenzo[b,d]thiopyran
- IUPAC
- 6H-benzo[c]thiochromene
Names & synonyms
6H-Dibenzo[b,d]thiopyran230-04-6DTXSID803087586H-Dibenzo(b,d)thiopyranRefChem:309627DTXCID502598846H-benzo[c]thiochromenedibenzothiopyranNSC208873SCHEMBL216973NSC-208873DS-005887
Database identifiers
- CAS
230-04-6- PubChem CID
- 308189
- DTXSID
DTXSID80308758- Nikkaji
- J1.280.793G
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 201
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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