Basic information
- CAS
4759-65-3- Standard SMILES
O=C1CC(C(F)(F)F)CC(=O)O1- InChIKey
PTGCUXZHDCRLEE-UHFFFAOYSA-N- Molecular formula
- C6H5F3O3
- Average molar mass
- 182.1 g/mol
Names & identifiers
- Preferred name
- 4-(Trifluoromethyl)dihydro-2H-pyran-2,6(3H)-dione
- IUPAC
- 4-(trifluoromethyl)oxane-2,6-dione
- English name
- 4-(trifluoroMethyl)dihydro-2H-pyran-2,6(3H)-dione
- Molecular formula
- C6H5F3O3
- Molecular weight
- 182.1
Names & synonyms
4759-65-34-(Trifluoromethyl)dihydro-2H-pyran-2,6(3H)-dione4-(TRIFLUOROMETHYL)OXANE-2,6-DIONEMFCD199820233-(trifluoromethyl)glutaric anhydrideSCHEMBL78323773-trifluoromethylglutaric anhydrideEAA75965AKOS0221864974-Trifluoromethyl-dihydro-pyran-2,6-dioneCS-02323734-(trifluoromethyl)tetrahydropyran-2,6-dione
Show more names
2H-Pyran-2,6(3H)-dione, dihydro-4-(trifluoroMethyl)-
EN300-1270614
Database identifiers
- CAS
4759-65-3- PubChem CID
- 15744244
- EC Number
- 876-857-7
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 205
Physicochemical properties
- Melting point
- 90 · 90-91 °C
- Boiling point
- 228.9 · 228.9±35.0 °C(Predicted)
- Density
- 1.473 · 1.473±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- 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
Chemistry & industry
Suppliers1 total
上海书亚医药科技有限公司400-685-9117 · [email protected]
Related reactions
16 records
Compound notes
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