Chloro[(1,3-dimesitylimidazol-2-ylidene)(N,N-dimethylbenzylamine)palladium(II)]

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CAS
1058661-78-1
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Purity
98%+
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Catalog Number

ACM1058661781-1

Product Name

Chloro[(1,3-dimesitylimidazol-2-ylidene)(N,N-dimethylbenzylamine)palladium(II)]

Structure

CAS

1058661-78-1

Category

Heterocyclic Organic Compound

Synonyms

[1,3-Bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]palladium;N,N-dimethyl-1-phenylmethanamine;chloride

IUPAC Name

[1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]palladium;N,N-dimethyl-1-phenylmethanamine;chloride

Molecular Weight

580.5

Molecular Formula

C30H36ClN3Pd

Canonical SMILES

CC1=CC(=C(C(=C1)C)N2C=CN(C2=[Pd])C3=C(C=C(C=C3C)C)C)C.CN(C)CC1=CC=CC=[C-]1.[Cl-]

InChI

InChI=1S/C21H24N2.C9H12N.ClH.Pd/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-10(2)8-9-6-4-3-5-7-9;/h7-12H,1-6H3;3-6H,8H2,1-2H3;1H;/q;-1;/p-1

InChI Key

DGPOQJVFBKBRDT-UHFFFAOYSA-M

Melting Point

225-230 °C

Appearance

Powder

Exact Mass

579.16326

H-Bond Acceptor

H-Bond Donor

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Monoisotopic Mass

579.16326

Rotatable Bond Count

Topological Polar Surface Area

9.7 Å²

MSDS

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COA

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Spec Sheet

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