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2,10-bis(3,5,5-trimethylhexyl)pentacene

2,10-bis(3,5,5-trimethylhexyl)pentacene

Systemtic Name:2,10-bis(3,5,5-trimethylhexyl)pentacene
Openeye Name:2,10-bis(3,5,5-trimethylhexyl)pentacene
CAS Name:2,10-bis(3,5,5-trimethylhexyl)pentacene
IUPAC Name:2,10-bis(3,5,5-trimethylhexyl)pentacene
Traditional Name:2,10-bis(3,5,5-trimethylhexyl)pentacene
Formula: C40H50
MolecularWeight: 530.825
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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=CC3=CC4=C(C=C5C=CC(=CC5=C4)CCC(C)CC(C)(C)C)C=C3C=C2C=C1)CC(C)(C)C


Isomeric SMILES

CC(CCC1=CC2=CC3=CC4=C(C=C5C=CC(=CC5=C4)CCC(C)CC(C)(C)C)C=C3C=C2C=C1)CC(C)(C)C


InChI

InChI=1S/C40H50/c1-27(25-39(3,4)5)9-11-29-13-15-31-19-35-23-36-20-32-16-14-30(12-10-28(2)26-40(6,7)8)18-34(32)22-38(36)24-37(35)21-33(31)17-29/h13-24,27-28H,9-12,25-26H2,1-8H3


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