3,3'-(Perfluorocyclopent-1-ene-1,2-diyl)bis(2,5-bis(4-(tert-butyl)phenyl)thiophene)

HCID 59615566
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Basic information

Standard SMILES
CC(C)(C)c1ccc(-c2cc(C3=C(c4cc(-c5ccc(C(C)(C)C)cc5)sc4-c4ccc(C(C)(C)C)cc4)C(F)(F)C(F)(F)C3(F)F)c(-c3ccc(C(C)(C)C)cc3)s2)cc1
InChIKey
IFRTTXUBWPZLAT-UHFFFAOYSA-N
Molecular formula
C53H54F6S2
Average molar mass
869.1 g/mol
Monoisotopic mass
868.35711304

Names & identifiers

Preferred name
3,3'-(Perfluorocyclopent-1-ene-1,2-diyl)bis(2,5-bis(4-(tert-butyl)phenyl)thiophene)
IUPAC
3-[2-[2,5-bis(4-tert-butylphenyl)thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2,5-bis(4-tert-butylphenyl)thiophene

Names & synonyms

3,3'-(perfluorocyclopent-1-ene-1,2-diyl)bis(2,5-bis(4-(tert-butyl)phenyl)thiophene)SCHEMBL10002015

Database identifiers

PubChem CID
59615566

Properties

Computed structural properties

XLogP
17.5
Topological polar surface area
56.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
10
Heavy atoms
61

Related reactions

1 records
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Compound notes

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