Scandium(III) 2,4-pentanedionate xhydrate

Catalog Number	ACM124302450
CAS	124302-45-0
Synonyms	Pentane-2,4-dione;scandium(3+);hydrate
Molecular Weight	360.29
Molecular Formula	C15H23O7Sc
Canonical SMILES	CC(=O)[CH-]C(=O)C.CC(=O)[CH-]C(=O)C.CC(=O)[CH-]C(=O)C.O.[Sc+3]
InChI	InChI=1S/3C5H7O2.H2O.Sc/c3*1-4(6)3-5(2)7;/h3*3H,1-2H3;1H2;/q3*-1;+3
InChI Key	CVECGEYICNFOOZ-UHFFFAOYSA-N
Purity	98%
Complexity	314
Covalently-Bonded Unit Count	5
Defined Atom Stereocenter Count	0
Exact Mass	360.100285
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	1
Monoisotopic Mass	360.100285
Rotatable Bond Count	0
Topological Polar Surface Area	103 Ų