Basic information
- CAS
80843-60-3- Standard SMILES
CC(C)(COCc1cccc(Oc2ccc(F)cc2)c1)c1ccc(Cl)cc1- InChIKey
TXUNPXGRECFOEW-UHFFFAOYSA-N- Molecular formula
- C23H22ClFO2
- Average molar mass
- 384.9 g/mol
- Monoisotopic mass
- 384.1292358
Names & identifiers
- Preferred name
- Benzene, 1-((2-(4-chlorophenyl)-2-methylpropoxy)methyl)-3-(4-fluorophenoxy)-
- IUPAC
- 1-chloro-4-[1-[[3-(4-fluorophenoxy)phenyl]methoxy]-2-methylpropan-2-yl]benzene
- English name
- 1-((2-(4-Chlorophenyl)-2-methylpropoxy)methyl)-3-(4-fluorophenoxy)benz ene
- Molecular formula
- C23H22ClFO2
- Molecular weight
- 384.87
Names & synonyms
80843-60-31-((2-(4-Chlorophenyl)-2-methylpropoxy)methyl)-3-(4-fluorophenoxy)benzeneBenzene, 1-((2-(4-chlorophenyl)-2-methylpropoxy)methyl)-3-(4-fluorophenoxy)-3-(4-Fluorophenoxy)benzyl 2-(4-chlorophenyl)-2-methylpropyl etherDTXSID002306681-{[2-(4-Chlorophenyl)-2-methylpropoxy]methyl}-3-(4-fluorophenoxy)benzeneRefChem:323459DTXCID30153159SCHEMBL108544141-((2-(4-Chlorophenyl)-2-methylpropoxy)methyl)-3-(4-fluorophenoxy)benz eneBenzene, 1-[[2-(4-chlorophenyl)-2-methylpropoxy]methyl]-3-(4-fluorophenoxy)-1-chloro-4-[1-[[3-(4-fluorophenoxy)phenyl]methoxy]-2-methylpropan-2-yl]benzene
Database identifiers
- CAS
80843-60-3- PubChem CID
- 3067115
- DTXSID
DTXSID00230668
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 428
Physicochemical properties
- Boiling point
- 456.8 · 456.8±45.0 °C(Predicted)
- Density
- 1.178 · 1.178±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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