Bis(3,5,3',5'-dimethoxydibenzylideneacetone)palladium(0)

Catalog Number	ACM811862778-1
CAS	811862-77-8
Structure
Synonyms	(1E,4E)-1,5-Bis(3,5-dimethoxyphenyl)penta-1,4-dien-3-one;palladium
Molecular Weight	815.2
Molecular Formula	C42H44O10Pd
Canonical SMILES	COC1=CC(=CC(=C1)C=CC(=O)C=CC2=CC(=CC(=C2)OC)OC)OC.COC1=CC(=CC(=C1)C=CC(=O)C=CC2=CC(=CC(=C2)OC)OC)OC.[Pd]
InChI	InChI=1S/2C21H22O5.Pd/c2*1-23-18-9-15(10-19(13-18)24-2)5-7-17(22)8-6-16-11-20(25-3)14-21(12-16)26-4;/h2*5-14H,1-4H3;/b2*7-5+,8-6+;
InChI Key	RTGAJOPJZJDWAX-XVGSOSPHSA-N
Melting Point	170-178 °C
Purity	98%
Appearance	Powder
Exact Mass	814.19693
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	0
Isomeric SMILES	COC1=CC(=CC(=C1)/C=C/C(=O)/C=C/C2=CC(=CC(=C2)OC)OC)OC.COC1=CC(=CC(=C1)/C=C/C(=O)/C=C/C2=CC(=CC(=C2)OC)OC)OC.[Pd]
Monoisotopic Mass	814.19693
Rotatable Bond Count	16
Topological Polar Surface Area	108 Ų