[3-(4-fluorophenoxy)phenyl]methyl (1R,2R)-2-chloro-1-(4-ethoxyphenyl)cyclopropane-1-carboxylate
Basic information
- CAS
101492-35-7- Standard SMILES
CCOc1ccc([C@@]2(C(=O)OCc3cccc(Oc4ccc(F)cc4)c3)C[C@H]2Cl)cc1- InChIKey
YVYVCQDLHSRCGE-NOZRDPDXSA-N- Molecular formula
- C25H22ClFO4
- Average molar mass
- 440.9 g/mol
- Monoisotopic mass
- 440.119065
Names & identifiers
- Preferred name
- [3-(4-fluorophenoxy)phenyl]methyl (1R,2R)-2-chloro-1-(4-ethoxyphenyl)cyclopropane-1-carboxylate
- IUPAC
- cis-[3-(4-fluorophenoxy)phenyl]methyl (1R,2R)-2-chloro-1-(4-ethoxyphenyl)cyclopropane-1-carboxylate
Names & synonyms
101492-35-7Cyclopropanecarboxylic acid, 2-chloro-1-(4-ethoxyphenyl)-, (3-(4-fluorophenoxy)phenyl)methyl ester, cis-DTXSID70906262[3-(4-fluorophenoxy)phenyl]methyl (1R,2R)-2-chloro-1-(4-ethoxyphenyl)cyclopropane-1-carboxylate[3-(4-fluorophenoxy)phenyl]methyl 2-chloro-1-(4-ethoxyphenyl)cyclopropane-1-carboxylate
Database identifiers
- CAS
101492-35-7- PubChem CID
- 180997
- DTXSID
DTXSID70906262
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 588
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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