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2,10-didodecylpentacene

2,10-didodecylpentacene

Systemtic Name:2,10-didodecylpentacene
Openeye Name:2,10-didodecylpentacene
CAS Name:2,10-didodecylpentacene
IUPAC Name:2,10-didodecylpentacene
Traditional Name:2,10-dilaurylpentacene
Formula: C46H62
MolecularWeight: 614.98448
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC2=CC3=CC4=C(C=C5C=CC(=CC5=C4)CCCCCCCCCCCC)C=C3C=C2C=C1


Isomeric SMILES

CCCCCCCCCCCCC1=CC2=CC3=CC4=C(C=C5C=CC(=CC5=C4)CCCCCCCCCCCC)C=C3C=C2C=C1


InChI

InChI=1S/C46H62/c1-3-5-7-9-11-13-15-17-19-21-23-37-25-27-39-31-43-35-44-32-40-28-26-38(24-22-20-18-16-14-12-10-8-6-4-2)30-42(40)34-46(44)36-45(43)33-41(39)29-37/h25-36H,3-24H2,1-2H3


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