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Naphthalene-bis(hexachlorocyclopentadiene) adduct

ALDRICH/184861

Synonym: DHA; NSC 122892

CAS Number: 5696-92-4
Empirical Formula (Hill Notation): C20H8Cl12
Molecular Weight: 673.71
EC Number: 227-171-6
MDL Number: MFCD00167975
Linear Formula: C20H8Cl12
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-184861-500G 500 g
 $160.00
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This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material.

This image depicts SKU: 184861-500G

 

form solid
InChI 1S/C20H8Cl12/c21-11-13(23)17(27)9-7(15(11,25)19(17,29)30)5-3-1-2-4-6(5)8-10(9)18(28)14(24)12(22)16(8,26)20(18,31)32/h1-4,7-10H/t7?,8?,9?,10?,15-,16+,17+,18-
InChI key ULBZLTIPWBXWCY-QDCKJYKTSA-N
mp 208-210 °C (lit.)
Quality Level 100 
SMILES string ClC1=C(Cl)[C@@]2(Cl)C3C(C4C(c5ccccc35)[C@@]6(Cl)C(Cl)=C(Cl)[C@]4(Cl)C6(Cl)Cl)[C@]1(Cl)C2(Cl)Cl
Application: Naphthalene-bis(hexachlorocyclopentadiene) adduct was used in the synthesis of:
• 2,3-diiodonaphthalene via iodination in methanesulfonic acid
• 2,3-dibromonapthalene via bromination
Application: Reactant involved in iodination and retro Diels-alder reactions

Molecule studied for its pharmacological activity as a KSP inhibitor
General description: Naphthalene-bis(hexachlorocyclopentadiene) adduct is precursor to substituted naphthalenes which are otherwise difficult to synthesize.
Packaging: 500 g in poly bottle
RIDADR NONH for all modes of transport
WGK Germany WGK 3
Flash Point(F) Not applicable
Flash Point(C) Not applicable
mp 208-210 °C (lit.)
UNSPSC 12352100

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