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2,3,3'-Trifluoro-4''-propyl-4-(2,2,2-trifluoroethoxy)-1,1':4',1''-terphenyl

HCID 175686117
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Basic information

Standard SMILES
CCCc1ccc(-c2ccc(-c3ccc(OCC(F)(F)F)c(F)c3F)cc2F)cc1
InChIKey
WQDMUGGFVKJJNN-UHFFFAOYSA-N
Molecular formula
C23H18F6O
Average molar mass
424.4 g/mol
Monoisotopic mass
424.12618417

Names & identifiers

Preferred name
2,3,3'-Trifluoro-4''-propyl-4-(2,2,2-trifluoroethoxy)-1,1':4',1''-terphenyl
IUPAC
2,3-difluoro-1-[3-fluoro-4-(4-propylphenyl)phenyl]-4-(2,2,2-trifluoroethoxy)benzene

Names & synonyms

2,3,3'-trifluoro-4''-propyl-4-(2,2,2-trifluoroethoxy)-1,1':4',1''-terphenyltFEtOtF3TDTXSID301380006

Database identifiers

PubChem CID
175686117
DTXSID
DTXSID301380006

Properties

Computed structural properties

XLogP
7.9
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
30
Formal charge
0
Complexity
518

Related reactions

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Compound notes

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