Structure of PBDB-T-F CAS 1802013-83-7

Iden­ti­fi­ca­tion

CAS Number

1802013-83-7

Name

PBDB-T-F CAS 1802013-83-7

Syn­onyms

9′-(2,12-di-tert-butyl-5,9-dioxa-13b-boranaphtho[3,2,1-de]anthracen-7-yl)-9,9”-diphenyl-9H,9’H,9”H-3,3′:6′,3”-tercarbazole ; PM6(PBDB-T-2F); TB-P3Cz ; PBDB-T-F ; PBDB-T-F,PM6 ; 9′-(2,12-di-tert-butyl-5,9-dioxa-13b-boranaphtho[3,2,1-de]anthracen-7-yl)-9,9”Chemicalbook-diphenyl-9H,9’H,9”H-3,3′:6′,3”-tercarbazole ; PCE14 ; P141-2F

SMILES

CCC(C)C1=CC=C(C=C1)O.CCC(C)C1=CC(=CC=C1)O.CCC(C)C1=CC(=C(C=C1)O)C.CCC(C)C1=CC(=C(C=C1)O)C.CCC(C)C1=CC=CC=C1O.CCC(C)C1=CC(=C(C(=C1)C)O)C.CCC(C)C1=C(C=C(C(=C1)C)O)C

Std­InChI

InChI=1S/2C12H18O.2C11H16O.3C10H14O/c1-5-8(2)11-6-10(4)12(13)7-9(11)3;1-5-8(2)11-6-9(3)12(13)10(4)7-11;2*1-4-8(2)10-5-6-11(12)9(3)7-10;1-3-8(2)9-4-6-10(11)7-5-9;1-3-8(2)9-5-4-6-10(11)7-9;1-3-8(2)9-6-4-5-7-10(9)11/h2*6-8,13H,5H2,1-4H3;2*5-8,12H,4H2,1-3H3;3*4-8,11H,3H2,1-2H3

Std­InChIKey

SGW­BYTCMEXVSFE-UHF­F­­FAOYSA-N

Mol­e­c­u­lar Formula

C76H110O7

Mol­e­c­u­lar Weight

1135.7

Prop­er­ties

Appear­ance

White pow­der

Safe­ty Data

RIDADR

NONH for all modes of transport

WGK Germany

3

Spec­i­fi­ca­tions and Oth­er Infor­ma­tion of Our PBDB-T-F CAS 1802013-83-7

Iden­ti­fi­ca­tion Methods

HNMR, HPLC

Puri­ty

98% min

HOMO

-5.45eV

LUMO

-3.65eV

Abs(edge)

~690nm

Shelf Life

2 years

Stor­age

Under room tem­per­a­ture away from light

Known Appli­ca­tion

Com­mon­ly used as OPV mate­ri­als and intermediates.

This prod­uct is devel­oped by our R&D com­pa­ny Warshel Chem­i­cal Ltd (https://​www​.warshel​.com/).

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