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6,13-Pentacenequinone

Catalog Number
ACM3029321
CAS Number
3029-32-1
Product Name
6,13-Pentacenequinone
Structure
Category
Small Molecule Semiconductor Building Blocks
IUPAC Name
pentacene-6,13-dione
Molecular Weight
308.3g/mol
Molecular Formula
C22H12O2
Canonical SMILES
C1=CC=C2C=C3C(=CC2=C1)C(=O)C4=CC5=CC=CC=C5C=C4C3=O
InChI
InChI=1S/C22H12O2/c23-21-17-9-13-5-1-2-6-14(13)10-18(17)22(24)20-12-16-8-4-3-7-15(16)11-19(20)21/h1-12H
InChI Key
UFCVADNIXDUEFZ-UHFFFAOYSA-N
Purity
>95.0%(LC)
Complexity
446
Covalently-Bonded Unit Count
1
Exact Mass
308.08373g/mol
Formal Charge
0
Heavy Atom Count
24
MeSH Entry Terms
6,13-pentacenequinone;6,13-PeQ
Monoisotopic Mass
308.08373g/mol
Rotatable Bond Count
0
XLogP3
5.4
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