Calcium acetylacetonate

Catalog Number	ACM19372442-1
CAS	19372-44-2
Structure
Synonyms	Calcium-bis(acetylacetonate)
Molecular Weight	238.29
Molecular Formula	C10H14CaO4
Canonical SMILES	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Ca+2]
InChI	InChI=1S/2C5H8O2.Ca/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;/q;+2/p-2/b2*4-3-;
InChI Key	QAZYYQMPRQKMAC-FDGPNNRMSA-L
Melting Point	175 °C
Purity	98%+
Appearance	Powder
Exact Mass	238.0517998
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isomeric SMILES	C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Ca+2]
Monoisotopic Mass	238.0517998
Rotatable Bond Count	2
Topological Polar Surface Area	80.3 Ų