Basic information
- Standard SMILES
O=Cc1cc2c(cc1OS(=O)(=O)C(F)(F)F)CCCC2- InChIKey
LUYOBLAHFIZEBV-UHFFFAOYSA-N- Molecular formula
- C12H11F3O4S
- Average molar mass
- 308.28 g/mol
Names & identifiers
- Preferred name
- 3-Formyl-5,6,7,8-tetrahydronaphthalen-2-yl trifluoromethanesulfonate
- IUPAC
- (3-formyl-5,6,7,8-tetrahydronaphthalen-2-yl) trifluoromethanesulfonate
Names & synonyms
3-formyl-5,6,7,8-tetrahydronaphthalen-2-yl trifluoromethanesulfonate944317-58-2SCHEMBL1506403DA-23593
Database identifiers
- PubChem CID
- 57576199
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 68.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 454
Related reactions
2 records
Compound notes
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