7-(Trifluoromethoxy)chroman-4-one
Basic information
- CAS
340825-26-5- Standard SMILES
O=C1CCOc2cc(OC(F)(F)F)ccc21- InChIKey
ROVOVSJXNSHPBD-UHFFFAOYSA-N- Molecular formula
- C10H7F3O3
- Average molar mass
- 232.16 g/mol
- Monoisotopic mass
- 232.03472857
Names & identifiers
- Preferred name
- 7-(Trifluoromethoxy)chroman-4-one
- IUPAC
- 7-(trifluoromethoxy)-2,3-dihydrochromen-4-one
- English name
- 7-(TRIFLUOROMETHOXY)CHROMAN-4-ONE
- Molecular formula
- C10H7F3O3
- Molecular weight
- 232.16
Names & synonyms
7-(trifluoromethoxy)chroman-4-one340825-26-5MFCD11518472SCHEMBL13506366BS-44543SY375785CS-01315767-(trifluoromethoxy)-2,3-dihydrochromen-4-oneY12410F6081957-(trifluoromethoxy)-3,4-dihydro-2H-1-benzopyran-4-one4H-1-Benzopyran-4-one, 2,3-dihydro-7-(trifluoromethoxy)-
Database identifiers
- CAS
340825-26-5- PubChem CID
- 70922643
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 277
Physicochemical properties
- Boiling point
- 283.7 · 283.7±40.0 °C(Predicted)
- Density
- 1.413 · 1.413±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Suppliers
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Related reactions
1 records
Compound notes
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