Basic information
- CAS
79781-90-1- Standard SMILES
CCOC(=O)C(C)(C)Oc1ccc(-c2ccc(F)cc2F)cc1- InChIKey
FSRRJCXRXQMNBY-UHFFFAOYSA-N- Molecular formula
- C18H18F2O3
- Average molar mass
- 320.3 g/mol
- Monoisotopic mass
- 320.12240076
Names & identifiers
- Preferred name
- Propanoic acid, 2-((2',4'-difluoro(1,1'-biphenyl)-4-yl)oxy)-2-methyl-, ethyl ester
- IUPAC
- ethyl 2-[4-(2,4-difluorophenyl)phenoxy]-2-methylpropanoate
Names & synonyms
79781-90-1Propanoic acid, 2-((2',4'-difluoro(1,1'-biphenyl)-4-yl)oxy)-2-methyl-, ethyl esterEthyl 2-((2',4'-difluoro(1,1'-biphenyl)-4-yl)oxy)-2-methylpropanoateDTXSID402299102-(2'',4''-Difluordiphenyl-4'-yloxy)-2-methylpropionsaeureaethylester [German]2-(2'',4''-Difluordiphenyl-4'-yloxy)-2-methylpropionsaeureaethylesterEthyl 2-[(2',4'-difluoro[1,1'-biphenyl]-4-yl)oxy]-2-methylpropanoateRefChem:374643DTXCID90152401
Database identifiers
- CAS
79781-90-1- PubChem CID
- 3061817
- DTXSID
DTXSID40229910
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 392
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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