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1-(2-Fluoro-3-(3-phenoxyphenyl)prop-1-enyl)-1-(4-trifluoromethoxyphenyl) cyclopropane

HCID 19083357
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Basic information

Standard SMILES
FC(=CC1(c2ccc(OC(F)(F)F)cc2)CC1)Cc1cccc(Oc2ccccc2)c1
InChIKey
YADWWNQHVYZLLU-UHFFFAOYSA-N
Molecular formula
C25H20F4O2
Average molar mass
428.4 g/mol

Names & identifiers

Preferred name
1-(2-Fluoro-3-(3-phenoxyphenyl)prop-1-enyl)-1-(4-trifluoromethoxyphenyl) cyclopropane
IUPAC
1-[1-[2-fluoro-3-(3-phenoxyphenyl)prop-1-enyl]cyclopropyl]-4-(trifluoromethoxy)benzene

Names & synonyms

1-(2-fluoro-3-(3-phenoxyphenyl)prop-1-enyl)-1-(4-trifluoromethoxyphenyl) cyclopropaneSCHEMBL8534006

Database identifiers

PubChem CID
19083357

Properties

Computed structural properties

XLogP
8
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
31
Formal charge
0
Complexity
599

Related reactions

2 records
New reaction record
HRID 146604 reaction equation
HRID 146604As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 963827 reaction equation
HRID 963827As productuspto-grants-1998_06

Compound notes

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