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CAS Number: 80663-92-9
2,5,8,11-tetra-tert-butylperylene

Structure

 2,5,8,11-tetra-tert-butylperylene
Name: 2,5,8,11-tetra-tert-butylperylene
Synonyms:
General Information
Product Number: 80663929

CAS Registry Number 80663-92-9
Name:
Perylene, 2,?5,?8,?11-?tetrakis(1,?1-?dimethylethyl)?-
2,5,8,11-Tetra-tert-butylperylene
2,5,8,11-Tetrakis(tert-butyl)perylene

 

Chemical Formula: C36H44
Exact Mass: 476.34
Molecular Weight: 476.73
m/z: 476.34 (100.0%), 477.35 (39.4%), 478.35 (7.6%)

 

InChI:InChI=1S/C36H44/c1-33(2,3)23-13-21-14-24(34(4,5)6)19-29-30-20-26(36(10,11)12)16-22-15-25(35(7,8)9)18-28(32(22)30)27(17-23)31(21)29/h13-20H,1-12H3

InChI Key:BFTIPCRZWILUIY-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)C1=CC2=C3C(=C1)C=C(C=C3C4=CC(=CC5=CC(=CC2=C54)C(C)(C)C)C(C)(C)C)C(C)(C)C

Specification

98%
References
  1. (2) Zhang, Xiujuan; Crystal Growth & Design 2011, V11(9), P3677-3680 CAPLUS
  2. (6) Zhang, Xiujuan; Angewandte Chemie, International Edition 2009, V48(48), P9121-9123, S9121/1-S9121/7 CAPLUS
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