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766453

Sigma-Aldrich

Iodo[4,5-bis(diphenylphosphino)-9,9-dimethylxanthene]copper(I)

Synonym(s):

Iodo[1,1′-(9,9-dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine-P)]copper(I)

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About This Item

Empirical Formula (Hill Notation):
C39H32CuIOP2
CAS Number:
1218788-80-7
Molecular Weight:
769.07
MDL number:
MFCD23098730
UNSPSC Code:
12161600
PubChem Substance ID:
329767238
NACRES:
NA.22

form

solid

Quality Level

100

reaction suitability

reaction type: Buchwald-Hartwig Cross Coupling Reaction
reaction type: Heck Reaction
reaction type: Hiyama Coupling
reaction type: Negishi Coupling
reaction type: Sonogashira Coupling
reaction type: Stille Coupling
reaction type: Suzuki-Miyaura Coupling
reagent type: ligand

mp

380-385 °C

functional group

phosphine

storage temp.

15-25°C

SMILES string

[Cu]I.CC1(C)c2cccc(P(c3ccccc3)c4ccccc4)c2Oc5c(cccc15)P(c6ccccc6)c7ccccc7

InChI

1S/C39H32OP2.Cu.HI/c1-39(2)33-25-15-27-35(41(29-17-7-3-8-18-29)30-19-9-4-10-20-30)37(33)40-38-34(39)26-16-28-36(38)42(31-21-11-5-12-22-31)32-23-13-6-14-24-32;;/h3-28H,1-2H3;;1H/q;+1;/p-1

InChI key

BEXLDSSXWBMGGT-UHFFFAOYSA-M

Application

Copper catalyst for cross coupling.

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

766453-VAR:
766453-500MG:4548173926445
766453-2G:4548173926438
766453-BULK:

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Certificates of Analysis (COA)

Lot/Batch Number
MKCM9546
MKCK1372
MKBN9082V
MKBL5761

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Jinkun Huang et al.
Journal of the American Chemical Society, 132(11), 3674-3675 (2010-02-26)
Heteroarenes are important structural moieties in many chemical industry fields. A highly efficient Pd/Cu-catalyzed C-H arylation method for a range of heterocycles has been discovered. It was found that the key to the success of this transformation is a combination

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