Carbonylchlorobis(triphenylphosphine)iridium(I)

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Catalog Number
ACM14871411-1
Product Name
Carbonylchlorobis(triphenylphosphine)iridium(I)
Structure
Structure
CAS
14871-41-1
Category
Iridium series of catalysts
Synonyms
Bis(triphenylphosphine)iridium(I) carbonyl chloride
IUPAC Name
formaldehyde;iridium;triphenylphosphane;chloride;
Molecular Weight
782.3
Molecular Formula
C37H32ClIrOP2
Canonical SMILES
C=O.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Ir]
InChI
InChI=1S/2C18H15P.CH2O.ClH.Ir/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;/h2*1-15H;1H2;1H;/p-1
InChI Key
XBRIWYFLOPNYFT-UHFFFAOYSA-M
Melting Point
215 °C
Appearance
Crystal
Application
Catalyst for the intramolecular carbonylative [2+2+1] cycloaddition of allenynes.

Catalyst for the selective hydrogenation of myrcene.

Catalyst for silylation of ortho-functionalized aryl halides with hydrosilanes.

Catalyst for synthesis of aldenamines from carboxamides by silane-reduction/dehydration under mild conditions.

Hydrogen atom transfer catalyst for radical cyclizations.

Complex for photocatalytic alkane dehydrogenation.

Catalyst for chemoselective reductive nucleophilic addition to N-methoxyamides.

Catalyst for chemoselective reductive alkynylation of tertiary amides.
Complexity
204
Covalently-Bonded Unit Count
5
EC Number
238-941-6
Exact Mass
782.12462
Formal Charge
-1
H-Bond Acceptor
2
Heavy Atom Count
42
Hydrogen Bond Acceptor Count
2
Hydrogen Bond Donor Count
0
Monoisotopic Mass
782.12462
Rotatable Bond Count
6
Topological Polar Surface Area
17.1 Ų
MSDS
Download MSDS
COA
Download COA
Spec Sheet
Download Spec Sheet
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