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

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

Systemtic Name:2,5-bis[2-(4-decylphenyl)ethynyl]-1,3-bis(fluoranyl)benzene
Openeye Name:2,5-bis[2-(4-decylphenyl)ethynyl]-1,3-difluoro-benzene
CAS Name:2,5-bis[2-(4-decylphenyl)ethynyl]-1,3-difluorobenzene
IUPAC Name:2,5-bis[2-(4-decylphenyl)ethynyl]-1,3-difluorobenzene
Traditional Name:2,5-bis[2-(4-decylphenyl)ethynyl]-1,3-difluoro-benzene
Formula: C42H52F2
MolecularWeight: 594.859086
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(C=C1)C#CC2=CC(=C(C(=C2)F)C#CC3=CC=C(C=C3)CCCCCCCCCC)F


Isomeric SMILES

CCCCCCCCCCC1=CC=C(C=C1)C#CC2=CC(=C(C(=C2)F)C#CC3=CC=C(C=C3)CCCCCCCCCC)F


InChI

InChI=1S/C42H52F2/c1-3-5-7-9-11-13-15-17-19-35-21-25-37(26-22-35)29-30-39-33-41(43)40(42(44)34-39)32-31-38-27-23-36(24-28-38)20-18-16-14-12-10-8-6-4-2/h21-28,33-34H,3-20H2,1-2H3


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