Structure

4FPEPTC

CAS
215726-57-1
Catalog Number
ACM215726571
Category
Organic Thin-Film Transistor (OTFT)
Molecular Weight
634.6g/mol
Molecular Formula
C40H24F2N2O4

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Specification

Synonyms
N,N-bis[2-(4-fluoro-phenyl)-ethyl]-3,4,9,10-perylene tetradicarboxiMide;2,9-Bis[2-(4-fluorophenyl)ethyl]anthra[2,1,9-def:6,5,10-d′e′f′]diisoquinoline-1,3,8,10(2H,9H)tetrone;2,9-Bis[2-(4-fluorophenyl)ethyl]anthra[2,1,9-def:6,5,10-def]diisoquinoline-1,3,8,1
IUPAC Name
7,18-bis[2-(4-fluorophenyl)ethyl]-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaene-6,8,17,19-tetrone
Canonical SMILES
C1=CC(=CC=C1CCN2C(=O)C3=C4C(=CC=C5C4=C(C=C3)C6=C7C5=CC=C8C7=C(C=C6)C(=O)N(C8=O)CCC9=CC=C(C=C9)F)C2=O)F
InChI
InChI=1S/C40H24F2N2O4/c41-23-5-1-21(2-6-23)17-19-43-37(45)29-13-9-25-27-11-15-31-36-32(40(48)44(39(31)47)20-18-22-3-7-24(42)8-4-22)16-12-28(34(27)36)26-10-14-30(38(43)46)35(29)33(25)26/h1-16H,17-20H2
InChI Key
NTVKTKREOVPUHX-UHFFFAOYSA-N
Complexity
1140
Covalently-Bonded Unit Count
1
Exact Mass
634.170414g/mol
Formal Charge
0
H-Bond Acceptor
6
H-Bond Donor
0
Heavy Atom Count
48
Monoisotopic Mass
634.170414g/mol
Rotatable Bond Count
6
XLogP3
7.8
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