CAS 12112-67-3 Chloro(1,5-cyclooctadiene)iridium(I) dimer

Synonyms

Bis(1,5-cyclooctadiene)diiridium(I) dichloride

IUPAC Name

(1Z,5Z)-cycloocta-1,5-diene;iridium;dichloride;

Molecular Weight

671.71

Molecular Formula

C16H24Cl2Ir2

InChI

InChI=1S/2C8H12.2ClH.2Ir/c2*1-2-4-6-8-7-5-3-1;/h2*1-2,7-8H,3-6H2;2*1H;/p-2/b2*2-1-,8-7-;

InChI Key

SHZHQWGWORCBJK-MIXQCLKLSA-L

Melting Point

205 °C

Purity

99%

Appearance

Red brown powder

Storage

2-8°C

Complexity

72.6

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

EC Number

235-170-7

Exact Mass

670.04902

Formal Charge

-2

H-Bond Acceptor

Heavy Atom Count

Isomeric SMILES

C1/C=C\CC/C=C\C1.C1/C=C\CC/C=C\C1.[Cl-].[Cl-].[Ir].[Ir]

Monoisotopic Mass

672.05135

Rotatable Bond Count

Topological Polar Surface Area

0 Å²

MSDS

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COA

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Spec Sheet

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Application

1. Precursor to catalysts for the asymmetric hydrogenation of tri- and tetrasubstituted olefins.

2. Precursor to catalyst for enantioselective reduction of imines.

3. Precursor to catalyst for allylic alkylation.

4. Precursor to catalyst for allylic amination and etherification.

5. Precursor to catalyst for the reaction of aroyl chlorides with internal alkynes to produce substituted naphthalenes and anthracenes.

6. Ir-catalyzed addition of acid chlorides to terminal alkynes.

7. Intramolecular hydroamination of unactivated alkenes with secondary alkyl- and arylamines.

8. Enantioselective [2+2] cycloaddition.

9. Silyl-directed, Ir-catalyzed ortho-borylation of arenes.

10. Ir-catalyzed cross-coupling of styrene derivatives with allylic carbonates.

11. Transfer hydrogenative C-C coupling