Erbium tris(2,2,6,6-tetramethyl-3,5-heptanedionate)

Catalog Number	ACM34750806-1
CAS	34750-80-6
Structure
Synonyms	Erbium(3+);2,2,6,6-tetramethylheptane-3,5-dione
IUPAC Name	erbium;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one
Molecular Weight	717.1
Molecular Formula	C33H57ErO6
Canonical SMILES	CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.[Er+3]
InChI	InChI=1S/3C11H19O2.Er/c3*1-10(2,3)8(12)7-9(13)11(4,5)6;/h3*7H,1-6H3;/q3*-1;+3
InChI Key	JCVVORSBZMJRBZ-UHFFFAOYSA-N
Melting Point	179-181 °C
Purity	99%
Density	g/cm³
Appearance	Solid
Exact Mass	715.345816
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	0
Monoisotopic Mass	715.345816
Rotatable Bond Count	6
Topological Polar Surface Area	102 Ų