Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2,3,3,3-tetrafluoro-1-propenyl)-, (3-phenoxyphenyl)methyl ester, (1-alpha,3-beta(E))-(+-)-
Basic information
- CAS
73176-66-6- Standard SMILES
CC1(C)[C@@H](/C=C(/F)C(F)(F)F)[C@@H]1C(=O)OCc1cccc(Oc2ccccc2)c1- InChIKey
LOYWCOCIPZLUCI-NGSBBRTASA-N- Molecular formula
- C22H20F4O3
- Average molar mass
- 408.4 g/mol
- Monoisotopic mass
- 408.13485714
Names & identifiers
- Preferred name
- Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2,3,3,3-tetrafluoro-1-propenyl)-, (3-phenoxyphenyl)methyl ester, (1-alpha,3-beta(E))-(+-)-
- IUPAC
- cis-(3-phenoxyphenyl)methyl (1S,3R)-2,2-dimethyl-3-[(E)-2,3,3,3-tetrafluoroprop-1-enyl]cyclopropane-1-carboxylate
Names & synonyms
73176-66-6Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2,3,3,3-tetrafluoro-1-propenyl)-, (3-phenoxyphenyl)methyl ester, (1-alpha,3-beta(E))-(+-)-RefChem:1082766
Database identifiers
- CAS
73176-66-6- PubChem CID
- 6447296
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 608
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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