Basic information
- CAS
6948-62-5- Standard SMILES
Cc1ccc2c(c1)CCC(c1ccccc1)S2- InChIKey
WYAUWGCLOUTYCW-UHFFFAOYSA-N- Molecular formula
- C16H16S
- Average molar mass
- 240.4 g/mol
- Monoisotopic mass
- 240.09727168
Names & identifiers
- Preferred name
- 6-Methyl-2-phenyl-3,4-dihydro-2h-thiochromene
- IUPAC
- 6-methyl-2-phenyl-3,4-dihydro-2H-thiochromene
Names & synonyms
6-methyl-2-phenyl-3,4-dihydro-2h-thiochromene6948-62-5NSC55794DTXSID80288420NSC-557946-METHYL-2-PHENYL-3,4-DIHYDRO-2H-1-BENZOTHIOPYRAN
Database identifiers
- CAS
6948-62-5- PubChem CID
- 244697
- DTXSID
DTXSID80288420
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 244
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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