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6,13-bis(4-butylphenyl)pentacene

6,13-bis(4-butylphenyl)pentacene

Systemtic Name:6,13-bis(4-butylphenyl)pentacene
Openeye Name:6,13-bis(4-butylphenyl)pentacene
CAS Name:6,13-bis(4-butylphenyl)pentacene
IUPAC Name:6,13-bis(4-butylphenyl)pentacene
Traditional Name:6,13-bis(4-butylphenyl)pentacene
Formula: C42H38
MolecularWeight: 542.75112
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=C3C=C4C=CC=CC4=CC3=C(C5=CC6=CC=CC=C6C=C52)C7=CC=C(C=C7)CCCC


Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=C3C=C4C=CC=CC4=CC3=C(C5=CC6=CC=CC=C6C=C52)C7=CC=C(C=C7)CCCC


InChI

InChI=1S/C42H38/c1-3-5-11-29-17-21-31(22-18-29)41-37-25-33-13-7-9-15-35(33)27-39(37)42(32-23-19-30(20-24-32)12-6-4-2)40-28-36-16-10-8-14-34(36)26-38(40)41/h7-10,13-28H,3-6,11-12H2,1-2H3


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