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CAS Number: 99762-80-8
5,12-dibutylquinolino[2,3-b]acridine-7,14(5H,12H)-dione

Structure

 5,12-dibutylquinolino[2,3-b]acridine-7,14(5H,12H)-dione
Name: 5,12-dibutylquinolino[2,3-b]acridine-7,14(5H,12H)-dione
Synonyms:
General Information
Product Number: 99762808

CAS Registry Number 99762-80-8
Name:
Quino[2,?3-?b]?acridine-?7,?14-?dione, 5,?12-?dibutyl-?5,?12-?dihydro-
N,N'-Dibutylquinacridone

 

Chemical Formula: C28H28N2O2
Exact Mass: 424.22
Molecular Weight: 424.53
m/z: 424.22 (100.0%), 425.22 (30.7%), 426.22 (5.2%)

 

InChI:InChI=1S/C28H28N2O2/c1-3-5-15-29-23-13-9-7-11-19(23)27(31)21-18-26-22(17-25(21)29)28(32)20-12-8-10-14-24(20)30(26)16-6-4-2/h7-14,17-18H,3-6,15-16H2,1-2H3

InChI Key:MYFHGRHNRNCMHV-UHFFFAOYSA-N

Canonical SMILES:CCCCN1C2=CC=CC=C2C(=O)C3=CC4=C(C=C31)C(=O)C5=CC=CC=C5N4CCCC

Specification

98%
References
  1. (1) Fan, Yan; Crystal Growth & Design 2009, V9(3), P1421-1430 CAPLUS
  2. (2) Ye, Kaiqi; Journal of Physical Chemistry B 2005, V109(16), P8008-8016 CAPLUS
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