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CAS Number: 351029-50-0
5'-bromo-4,4''-di-tert-butyl-1,1':3',1''-terphenyl

Structure

5'-bromo-4,4''-di-tert-butyl-1,1':3',1''-terphenyl
Name: 5'-bromo-4,4''-di-tert-butyl-1,1':3',1''-terphenyl
Synonyms:
General Information
Product Number: 351029500

CAS Registry Number: 351029-50-0

Name:

1,​1':3',​1''-​Terphenyl, 5'-​bromo-​4,​4''-​bis(1,​1-​dimethylethyl)​-
3,​5-​Bis(p-​tert-​butylphenyl)​-​1-​bromobenzene 

 

Chemical Formula: C26H29Br
Exact Mass: 420.15
Molecular Weight: 421.41
m/z: 420.15 (100.0%), 422.14 (97.3%), 421.15 (28.5%), 423.15 (27.7%), 422.15 (3.9%), 424.15 (3.8%)
Elemental Analysis: C, 74.10; H, 6.94; Br, 18.96

 

InChI: InChI=1S/C16H19N3O3/c1-3-14(20)18-19-15-12(16(21)22-4-2)10-13(17-15)11-8-6-5-7-9-11/h5-10,17,19H,3-4H2,1-2H3,(H,18,20)
InChIKey: JZDZVURJECYFOY-UHFFFAOYSA-N
Canonical SMILES : CCC(=O)NNC1=C(C=C(N1)C2=CC=CC=C2)C(=O)OCC

Specification

98%

References
  1. (1) Zhang, Yong; Journal of Luminescence 2007, V124(1), P51-57 CAPLUS
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