Completing data — usually done within a minute
Basic information
- CAS
87789-46-6- Standard SMILES
CC(C)(C)Oc1ccc(OC(F)F)cc1- InChIKey
JYVMAWKUHYHRSA-UHFFFAOYSA-N- Molecular formula
- C11H14F2O2
- Average molar mass
- 216.22 g/mol
- Monoisotopic mass
- 216.09618601
Names & identifiers
- Preferred name
- 1-tert-Butoxy-4-(difluoromethoxy)benzene
- IUPAC
- 1-(difluoromethoxy)-4-[(2-methylpropan-2-yl)oxy]benzene
Names & synonyms
87789-46-61-tert-Butoxy-4-(difluoromethoxy)benzeneBenzene, 1-(difluoromethoxy)-4-(1,1-dimethylethoxy)-SCHEMBL10467057DTXSID606230171-(difluoromethoxy)-4-(tert.-butoxy)benzene
Database identifiers
- CAS
87789-46-6- PubChem CID
- 22156396
- DTXSID
DTXSID60623017
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 182
Related reactions
2 records
Compound notes
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