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CAS Number: 572-83-8
2-bromoanthracene-9,10-dione

Structure

2-bromoanthracene-9,10-dione
Name: 2-bromoanthracene-9,10-dione
Synonyms:
General Information
Product Number: 572838
CAS Registry Number:
572-83-8
Name:
9,​10-​Anthracenedione, 2-​bromo-
Anthraquinone, 2-​bromo- (6CI,​7CI,​8CI); 2-​Bromo-​9,​10-​anthraquinone; 2-​Bromoanthraquinone; NSC 4633; β-​Bromoanthraquinone 
 
Chemical Formula: C14H7BrO2
Exact Mass: 285.96
Molecular Weight: 287.11
m/z: 285.96 (100.0%), 287.96 (97.3%), 286.97 (15.3%), 288.96 (14.7%), 287.97 (1.5%), 289.97 (1.5%)
Elemental Analysis: C, 58.57; H, 2.46; Br, 27.83; O, 11.15
 
InChI: InChI=1S/C14H7BrO2/c15-8-5-6-11-12(7-8)14(17)10-4-2-1-3-9(10)13(11)16/h1-7H
InChIKey: VTSDGYDTWADUJQ-UHFFFAOYSA-N
Canonical SMILES : C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)Br
 
Thermal Properties Value Condition Note
Melting Point 209-210 °C   (9)CAS
Melting Point 207.5 °C   (7)CAS
Melting Point 206-207 °C Solv: benzene (71-43-2) (3)CAS
Melting Point 205.8 °C   (10)SRC
Melting Point 205-206 °C   (11)CAS
Melting Point 204-205 °C   (12)CAS
Melting Point See full text   (4)CAS

Specification

98%

References

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  • (6) Kim, Ji-Eun; WO 2008013399 A1 2008 CAPLUS
  • (7) Kim, Ji-Eun; WO 2003095445 A1 2003 CAPLUS
  • (8) Asfandiarov, N. L.; Rapid Communications in Mass Spectrometry 2001, V15(19), P1869-1878 CAPLUS
  • (9) Velluz, Leon; Bulletin de la Societe Chimique de France, Memoires 1938, V5, P192-6 CAPLUS
  • (10) "PhysProp" data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
  • (11) Madje, Balaji R.; Green Chemistry Letters and Reviews 2010, V3(4), P269-273 CAPLUS
  • (12) Grandmougin, Eugene; Compt. rend. 1921, V173, P1176-8 CAPLUS
  • (13) Yoon, Seok-Hee; WO 2003060956 A2 2003 CAPLUS
  • (14) Coleman, Robert S.; Tetrahedron Letters 2003, V44(6), P1215-1219 CAPLUS
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