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CAS Number: 30675-13-9
4,5,6,7-tetrachloro-1H-indene-1,3(2H)-dione

Structure

 4,5,6,7-tetrachloro-1H-indene-1,3(2H)-dione
Name: 4,5,6,7-tetrachloro-1H-indene-1,3(2H)-dione
Synonyms:
General Information
Product Number: 30675139

CAS Registry Number 30675-13-9
Name:
1H-?Indene-?1,?3(2H)?-?dione, 4,?5,?6,?7-?tetrachloro-
1,3-Indandione, 4,5,6,7-tetrachloro- (8CI)
4,5,6,7-Tetrachloro-1H-indene-1,3(2H)-dione
4,5,6,7-Tetrachloro-1,3-indandione

 

Chemical Formula: C9H2Cl4O2
Exact Mass: 281.88
Molecular Weight: 283.92
m/z: 283.88 (100.0%), 281.88 (78.2%), 285.87 (47.9%), 287.87 (10.2%), 284.88 (9.8%), 282.88 (7.6%), 286.88 (4.7%), 288.88 (1.0%)

 

InChI:InChI=1S/C9H2Cl4O2/c10-6-4-2(14)1-3(15)5(4)7(11)9(13)8(6)12/h1H2

InChI Key:IDLAOWFFKWRNHB-UHFFFAOYSA-N

Canonical SMILES:C1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl

 

Thermal Properties Value Condition Note
Melting Point 230 °C   (1)IC
Melting Point >135 °C (decomp) Solv: benzene (71-43-2) (2)CAS
Thermal Analysis See full text   (3)CAS

Specification

98%
References
  1. (1) De Winter, Marius L.; European Journal of Medicinal Chemistry 1977, V12(2), P125-30 CAPLUS
  2. (2) Marvi, Omid; Bulletin of the Korean Chemical Society 2009, V30(12), P2918-2920 CAPLUS
  3. (3) Graciet, Jean-Christophe; WO 2007090797 A2 2007 CAPLUS
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