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CAS Number: 830325-93-4
4-(7-bromobenzo[c][1,2,5]thiadiazol-4-yl)-N,N-diphenylaniline

Structure

4-(7-bromobenzo[c][1,2,5]thiadiazol-4-yl)-N,N-diphenylaniline
Name: 4-(7-bromobenzo[c][1,2,5]thiadiazol-4-yl)-N,N-diphenylaniline
Synonyms:
General Information
Product Number: 830325934

CAS Registry Number 830325-93-4
Name:
Benzenamine, 4-​(7-​bromo-​2,​1,​3-​benzothiadiazol-​4-​yl)​-​N,​N-​diphenyl-
4-Bromo-7-[4-(diphenylamino)phenyl]-2,1,3-benzothiadiazole

 

Chemical Formula: C24H16BrN3S
Exact Mass: 457.02
Molecular Weight: 458.37
m/z: 459.02 (100.0%), 457.02 (98.2%), 458.03 (25.7%), 460.03 (25.3%), 461.02 (4.6%), 459.03 (3.7%), 461.03 (3.5%), 460.02 (3.0%), 458.02 (1.9%), 462.02 (1.2%)

 

InChI:InChI=1S/C24H16BrN3S/c25-22-16-15-21(23-24(22)27-29-26-23)17-11-13-20(14-12-17)28(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-16H

InChI Key:JGFDGXZMVJYTLH-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=C(C5=NSN=C45)Br

 

Thermal Properties Value Condition Note
Melting Point 64-66 °C Solv: dichloromethane (75-09-2); hexane (110-54-3) (3)CAS
Melting Point 63.3-66.8 °C   (2)CAS

Specification

98%

References
  1. (2) Mataga, Shuntaro; JP 2006251351 A 2006 CAPLUS
  2. (3) Ishi-i, Tsutomu; Journal of Materials Chemistry 2007, V17(31), P3341-3346 CAPLUS
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