Basic information
- Standard SMILES
CCCc1cc(C(OCOC)(C(F)(F)F)C(F)(F)F)ccc1OCc1ccccc1- InChIKey
IASKLODNBKLBJA-UHFFFAOYSA-N- Molecular formula
- C21H22F6O3
- Average molar mass
- 436.4 g/mol
- Monoisotopic mass
- 436.14731353
Names & identifiers
- Preferred name
- 4-[1,1,1,3,3,3-Hexafluoro-2-(methoxymethyl)oxypropan-2-yl]-2-propylphenyl benzyl ether
- IUPAC
- 4-[1,1,1,3,3,3-hexafluoro-2-(methoxymethoxy)propan-2-yl]-1-phenylmethoxy-2-propylbenzene
Names & synonyms
4-[1,1,1,3,3,3-hexafluoro-2-(methoxymethyl)oxypropan-2-yl]-2-propylphenyl benzyl etherSCHEMBL542176
Database identifiers
- PubChem CID
- 59201148
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 9
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 488
Related reactions
3 records
Compound notes
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