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1,3-bis(fluoranyl)-2,5-bis[2-(4-octylphenyl)ethynyl]benzene

1,3-bis(fluoranyl)-2,5-bis[2-(4-octylphenyl)ethynyl]benzene

Systemtic Name:1,3-bis(fluoranyl)-2,5-bis[2-(4-octylphenyl)ethynyl]benzene
Openeye Name:1,3-difluoro-2,5-bis[2-(4-octylphenyl)ethynyl]benzene
CAS Name:1,3-difluoro-2,5-bis[2-(4-octylphenyl)ethynyl]benzene
IUPAC Name:1,3-difluoro-2,5-bis[2-(4-octylphenyl)ethynyl]benzene
Traditional Name:1,3-difluoro-2,5-bis[2-(4-octylphenyl)ethynyl]benzene
Formula: C38H44F2
MolecularWeight: 538.752766
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C#CC2=CC(=C(C(=C2)F)C#CC3=CC=C(C=C3)CCCCCCCC)F


Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C#CC2=CC(=C(C(=C2)F)C#CC3=CC=C(C=C3)CCCCCCCC)F


InChI

InChI=1S/C38H44F2/c1-3-5-7-9-11-13-15-31-17-21-33(22-18-31)25-26-35-29-37(39)36(38(40)30-35)28-27-34-23-19-32(20-24-34)16-14-12-10-8-6-4-2/h17-24,29-30H,3-16H2,1-2H3


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