1-Cyclopropoxy-2-isopropoxy-4-(trifluoromethyl)benzene
Basic information
- CAS
1243458-20-9- Standard SMILES
CC(C)Oc1cc(C(F)(F)F)ccc1OC1CC1- InChIKey
BDANQTZSBKEVLS-UHFFFAOYSA-N- Molecular formula
- C13H15F3O2
- Average molar mass
- 260.25 g/mol
- Monoisotopic mass
- 260.1024142
Names & identifiers
- Preferred name
- 1-Cyclopropoxy-2-isopropoxy-4-(trifluoromethyl)benzene
- IUPAC
- 1-cyclopropyloxy-2-propan-2-yloxy-4-(trifluoromethyl)benzene
Names & synonyms
1243458-20-91-CYCLOPROPOXY-2-ISOPROPOXY-4-(TRIFLUOROMETHYL)BENZENEDTXSID101173029MB355041-(Cyclopropyloxy)-2-(1-methylethoxy)-4-(trifluoromethyl)benzene1-(Cyclopropyloxy)-2-[(propan-2-yl)oxy]-4-(trifluoromethyl)benzene
Database identifiers
- CAS
1243458-20-9- PubChem CID
- 72226348
- DTXSID
DTXSID101173029
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 274
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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